name,mzmed,rtmed,vip,Pvalue,FC,change,FDR,Log2FC,X.log10Pvalue,mode,X11,N31,X35,N15,N8,X9,N22,X16,X36,X28,N26,N12,X20,N20,X38,X19,X39,X37,N6,N16,X34,N21,N4,N11,X7,X30,N23,N2,X5,X33,X32,N17,N14,X12,N3,N24,X31,X10,X24,X13,X29,X25,X3,X15,X40,N10,X8,N29,mz1,mz2,change2,lipid,lipidcheck,Mz,Rt,Alignment.ID,Adduct.type,Formula,Ontology,INCHIKEY,SMILES,Dot.product,Reverse.dot.product,MS1.isotopic.spectrum,MS/MS.spectrum,i.mz1,i.mz2
M101T53,101.0599013,52.85985,0.870008096,0.011565978,1.238134718,NS,0.0310803,0.308168299,1.936817637,neg,3.328151639,2.676680515,1.654183787,2.020836375,1.695370034,2.11167542,1.651569498,1.758164375,1.835783261,1.993833282,1.908040361,1.572625252,2.361808331,2.12859004,1.118891537,2.558051747,1.687325149,1.433377753,1.879222206,1.624404792,2.18086396,1.174709273,1.532773048,1.608813799,3.01928974,1.829351204,0.862880595,1.645495146,2.705371295,1.67281176,1.457997748,1.663797886,1.655066316,3.632016952,1.354770678,2.147576402,1.540089077,2.136561984,2.008186591,2.445796286,1.451856015,1.414321297,1.075370009,2.587052922,2.447364672,1.014056908,2.115898285,1.390188556,101.059396,101.0604066,Ns,FA 5:0,S,101.05999,0.884,142,[M-H]-,C5H10O2,FA,NQPDZGIKBAWPEJ-UHFFFAOYSA-N,O=C(O)CCCC,75,75,101.06002:3702416 102.06337:540938 103.06673:0,50.29452:2876 55.01775:20100 57.03343:12739 59.01279:39732 59.05174:3115 62.03168:3331 71.01272:6842 73.02832:8562 83.01289:6996 84.04476:4029 87.33226:5505 99.04428:8921 101.06:1020323,101.05999,101.05999
M157T63,157.1232033,63.4587,0.781908178,0.027724987,0.905332447,NS,0.062858532,-0.143480434,1.55712865,neg,4.859653207,4.769753831,3.48590034,5.002133736,4.977469177,4.417678788,4.316616499,4.821990234,2.918515413,3.699585383,4.726803855,4.316849593,4.252192464,4.911740942,3.057696143,4.505501448,3.330991852,3.501281676,5.068699427,4.912014724,3.462261713,3.769207569,4.068839266,4.354101307,5.017668748,3.278766978,3.161652623,5.268321986,4.590490429,3.593330956,3.70786172,4.615968196,5.257347302,5.318930057,4.149486749,5.31599404,3.697586645,5.324246499,4.321428432,5.38853391,3.825337203,3.913385652,4.545573863,4.695049714,3.274945545,3.734990817,4.837366321,4.54217084,157.1224176,157.1239889,Ns,FA 9:0,S,157.12331,1.058,634,[M-H]-,C9H18O2,FA,FBUKVWPVBMHYJY-UHFFFAOYSA-N,O=C(O)CCCCCCCC,65.2,75,157.12331:4304614 158.12666:489988 159.13002:0,59.01273:252532 60.01613:6306 61.82121:2098 61.98728:8737 64.97039:1974 71.72562:1991 72.99201:4068 73.02858:2772 74.02386:7427 75.00776:8321 75.29493:2428 78.81609:1942 89.02369:5661 100.93285:4101 103.47095:1852 104.09284:2044 111.08073:3097 113.09667:6397 115.92005:33157 143.94896:2641 157.08719:22588 157.12328:219770,157.12331,157.12331
M171T69,171.1390674,68.5301,0.779624917,0.077866365,0.798712397,NS,0.141510317,-0.324251988,1.1086501,neg,4.090235454,3.436039558,2.924319698,12.56023123,4.31813411,4.594176596,3.52155237,4.412623939,2.647824268,3.622435578,4.181577177,4.300016186,3.698211443,4.039621088,2.880246368,3.468357278,3.224543958,3.222916866,4.054898217,7.997066124,3.007266677,2.94318629,3.359686229,4.351174149,3.520785785,4.129183314,4.901623615,3.956021413,4.370024019,3.877572763,3.801353619,4.386768388,3.903441859,4.049723111,3.760497864,4.966242259,3.348161114,3.61358822,2.941647523,4.401917549,3.809487244,3.656442154,3.641675271,4.278197652,3.271442256,2.835873152,3.423432591,3.380018304,171.1382117,171.1399231,Ns,FA 10:0,S,171.13919,1.139,749,[M-H]-,C10H20O2,FA,GHVNFZFCNZKVNT-UHFFFAOYSA-N,O=C(O)CCCCCCCCC,64.6,75,171.13921:2805676 172.14256:370438 173.14592:19638,55.31897:1973 56.46656:2311 59.01275:11148 60.99175:2438 61.98727:3617 71.69676:2270 79.95627:2271 87.48747:2372 88.03953:6881 88.41051:2160 88.98707:11637 89.02349:171255 90.02682:7884 93.03369:9479 99.08105:2487 125.09644:3417 127.07596:3341 127.11235:11134 131.08192:23232 139.13242:2114 153.09172:3250 169.12303:6623 170.12653:4199 171.02026:32009 171.10309:52838 171.13908:424010,171.13919,171.13919
M185T78,185.1550337,77.9938,1.152873857,0.001066249,0.84849785,NS,0.004569503,-0.23701709,2.972141254,neg,3.699805117,2.974830747,2.975534211,4.660459406,4.374303841,3.502114721,3.712944496,5.127585446,2.468760873,3.170680817,4.206186903,3.811491756,3.589214776,4.341773755,2.822292006,3.64388286,2.982947506,2.964052257,4.548841586,4.328236903,3.17043951,3.487583312,3.82732066,4.021592127,3.721203127,3.260585307,2.935489335,4.413931043,3.547868782,3.332141431,3.189641479,4.335570314,4.768141116,4.105476686,4.021586929,5.041839558,3.324309552,3.26873358,3.428989076,5.463174872,3.35545912,3.175446695,3.394377895,3.615838896,2.691483899,3.249580608,3.122459227,3.84977234,185.1541079,185.1559595,Ns,FA 11:0,S,185.15514,1.311,851,[M-H]-,C11H22O2,FA,ZDPHROOEEOARMN-UHFFFAOYSA-N,O=C(O)CCCCCCCCCC,62.5,75,185.15514:844223 186.15849:120229 187.16185:0,59.01273:10986 61.98717:4332 70.25732:2046 70.65826:1863 72.992:4480 74.53928:1923 79.95654:2694 89.02338:2013 102.05525:3401 103.03915:15294 104.03469:5098 107.04937:6337 114.74179:2447 141.09128:3841 141.12811:2942 183.13898:2943 185.11989:13108 185.155:119847,185.15514,185.15514
M199T89,199.17095,89.1791,0.97421684,0.005885743,0.825122312,NS,0.018149987,-0.277320102,2.230198673,neg,3.456123375,2.954800953,1.988559232,4.422841922,4.244235511,3.614759166,3.006693344,4.157747308,2.429737246,2.698962017,3.324200691,3.771129383,3.184225589,3.675912318,2.322298314,2.46957289,2.592856691,2.780599349,4.048425963,4.402787895,2.383132479,2.907881783,3.696896077,3.812296734,2.75630031,4.970772875,2.403971914,3.511123525,3.373829673,3.486071816,2.496810569,4.62729804,3.561702127,3.32008994,3.860883845,5.222373111,2.753613097,2.961498713,2.214946419,2.90778741,2.83449918,2.750920293,2.71631343,3.212281169,5.300180095,2.341005592,2.192833313,3.203384931,199.1699541,199.1719458,Ns,FA 12:0,S,199.17104,1.485,969,[M-H]-,C12H24O2,FA,POULHZVOKOAJMA-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCC,74.3,75,199.17104:7532834 200.17439:1132036 201.17775:57239,59.01273:46735 61.98721:13121 83.62558:2567 99.08046:2768 108.31423:2729 109.37932:3428 115.51865:2411 116.0707:8166 116.9716:4700 118.05007:2837 145.5132:2806 159.0152:3440 162.07794:2764 169.38399:2713 180.88097:2713 199.13361:10913 199.17093:482508,199.17104,199.17104
M211T85,211.1711513,85.2471,1.504611346,8.49E-05,0.610594818,NS,0.000559788,-0.71171275,4.071158327,neg,1.959643441,4.443086861,2.142848426,4.480913588,3.821629528,4.547790027,4.17511586,2.390307229,1.525771146,2.747367269,2.699717097,4.605891333,2.91409569,4.58743018,1.937574202,2.148567802,2.53492127,2.044844393,3.185501479,4.45703441,2.343395684,2.786089043,2.463313258,8.860590968,2.864912797,4.429543047,3.521457555,2.304904147,3.310229259,2.241864264,2.018022341,4.124906219,3.340124539,2.358351021,4.445027747,4.927687841,2.221957547,3.083510076,1.713614111,2.926696154,2.209804816,1.953112454,2.025701037,2.364033634,2.491241948,3.28678204,1.388504129,4.011093355,211.1700954,211.1722072,Down,FA 13:1,S,211.1713,1.43,1106,[M-H]-,C13H24O2,FA,KIWIPIAOWPKUNM-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCC,34.5,75,211.17131:321587 212.17466:54237 213.17802:116727,51.27963:1917 59.01255:2788 61.66879:2370 61.98738:4062 67.16671:1934 69.81808:2405 72.8139:2226 91.89961:2187 109.06501:7180 111.08064:10230 121.38769:2133 128.03474:2236 130.08669:9958 131.08188:8417 133.05347:2156 142.32388:2243 154.06296:24373 167.14427:23043 168.14777:4942 211.13503:10366 211.17101:46573,211.1713,211.1713
M213T106,213.1868205,105.774,0.525526075,0.156184885,0.876258762,NS,0.246223235,-0.190571129,0.806360997,neg,3.265236675,3.245334083,2.756264754,6.566931751,3.64111944,3.937597828,3.428711393,3.322871996,2.581881081,3.14624587,3.317913824,4.27152514,4.171513656,4.368327338,2.759473767,2.927655466,4.642596811,3.089761735,3.607502607,6.678229855,2.97944654,2.958497819,2.874057542,5.924422306,3.377488242,8.510888134,2.772922689,3.558783032,3.413545184,4.224334752,3.253513975,3.418441078,4.039143539,3.417206794,4.043914272,4.091720758,3.009005313,3.382508687,2.885497943,3.000778889,3.63721575,3.311290186,2.759837611,3.180074479,2.713549173,2.771605216,2.699780717,2.966727562,213.1857545,213.1878864,Ns,FA 13:0,D,213.18684,1.757,1121,[M-H]-,C13H26O2,FA,SZHOJFHSIKHZHA-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCC,67.7,75,213.18684:976327 214.19019:169739 215.19355:0,60.46399:2277 61.98722:6968 71.48646:2253 82.26865:2189 84.98268:2266 130.08667:4987 131.08211:15602 154.06259:3516 174.90471:2693 213.18675:162406,213.18684,213.18684
M213T95,213.1868935,94.559,2.063788671,2.03E-09,0.717424124,NS,4.22E-08,-0.479101838,8.693313945,neg,3.201329621,3.987773365,2.624227702,4.347492124,4.229565925,2.936101536,3.890863063,3.475057131,2.249431207,2.740324332,4.180209091,3.824497172,2.977058214,4.208300789,2.620787255,2.905129897,2.55273233,2.641760715,4.580424096,4.155600564,2.918400809,3.440733695,3.897731657,3.6459782,3.38481666,2.584924334,2.850416395,4.405276094,3.009607224,3.06861104,2.95427752,4.463451412,4.682239887,3.404848539,3.735662859,5.20413629,2.931247284,2.974615332,2.99690784,2.904394759,2.974416251,3.043433979,2.827832939,3.108359175,2.564168584,3.26632927,2.767700274,3.989983508,213.1858276,213.1879594,Ns,FA 13:0,D_NS,213.18695,1.583,1123,[M-H]-,C13H26O2,FA,SZHOJFHSIKHZHA-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCC,68.7,75,213.18695:1111039 214.1903:160160 215.19366:8382,59.01254:2238 61.98711:4955 66.18237:2084 82.44943:2193 90.85752:2444 109.06503:3091 130.08643:6382 131.08203:15555 154.06274:4090 213.15126:8357 213.1868:201069,213.18695,213.18695
M225T99,225.1869813,98.5402,0.325811933,0.401311599,1.222013305,NS,0.511987884,0.289259993,0.396518288,neg,2.971951589,0.930943525,0.460550034,8.951322601,3.654168809,7.992522251,1.456962904,3.541580099,3.840980915,3.275603983,0.681986893,1.629965121,3.089142472,1.724463291,2.214469586,1.576279124,2.994239908,2.668146223,0.987589231,8.890949325,1.656705398,0.881211662,2.307600296,3.385370526,1.101736494,7.457183833,1.023737726,1.561083531,4.735122048,5.892248168,1.548607647,3.145041525,0.692548304,1.79996432,4.43654307,2.775271399,2.687164001,3.114008105,0.501534757,5.090240134,2.500193356,2.858513437,2.831063504,3.738527574,2.98975198,0.550243755,0.623649612,0.456182688,225.1858554,225.1881073,Ns,FA 14:1,S,225.18709,1.653,1294,[M-H]-,C14H26O2,FA,YWWVWXASSLXJHU-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCCC,72.6,75,225.18709:4118758 226.19044:662912 227.1938:424777,52.27703:2885 55.45295:2937 59.01271:52335 60.01601:6498 60.80761:2824 61.98724:35222 62.01693:2854 71.01278:4930 85.49486:3023 92.92729:3665 97.06521:3138 126.8951:3133 128.44061:3186 145.09793:7683 207.17659:8493 213.63136:3110 215.63048:3098 225.18697:393095,225.18709,225.18709
M227T129,227.2025315,128.5945,1.681990509,2.71E-08,1.823917647,NS,4.39E-07,0.86704059,7.567152252,neg,4.643511833,1.854924661,4.409931874,3.435988857,3.044826129,5.224636771,2.48838327,4.29326009,5.257057449,5.761514221,2.028638694,3.016758596,4.467739612,2.059247808,4.400796641,2.754468409,5.436487386,5.961717555,2.121970545,3.336118602,4.891582022,2.155459546,2.982341757,3.762470906,3.318338017,8.543101588,1.539603506,2.678126591,5.144094687,7.138823948,5.071599435,3.171300076,2.189693964,3.932787912,3.685277838,3.865133323,6.19160341,4.160938172,1.699508497,3.902595755,6.625984809,6.521836776,3.449429387,4.240492629,5.764852712,1.775269896,2.518567111,1.962204103,227.2013955,227.2036675,Up,FA 14:0,S,227.20256,2.149,1328,[M-H]-,C14H28O2,FA,TUNFSRHWOTWDNC-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCC,75,75,227.20256:40015136 228.20591:6938466 229.20927:418537,51.22176:5425 56.40462:4711 61.98734:37821 62.49647:5458 83.28986:5219 87.98427:6048 88.94808:6091 102.04707:5483 112.2794:5612 150.48315:7241 182.8353:5937 209.19199:12078 227.20265:2192870,227.20256,227.20256
M233T85,233.1558644,84.749,1.43535949,5.37E-06,5.470983092,Up,5.24E-05,2.451800097,5.270151275,neg,2.675365764,1.880160617,24.40850019,2.153068573,2.162407366,2.704105777,2.086214631,2.750019129,14.32020394,25.9994874,2.185171218,1.937235371,2.798539194,1.944985007,25.52761276,3.515542252,19.8135302,15.25579804,2.512848601,2.187685382,16.70965151,1.772651009,2.142284359,1.963895354,3.586044247,14.8211095,1.383140016,2.345538222,2.993819864,18.67056832,16.53336494,2.316374087,2.214373745,4.579953267,2.110974059,2.349402577,18.38190616,2.802084815,3.371852575,2.881037862,21.26169912,19.40662775,3.39784526,4.120961466,22.45947807,1.920848489,3.568175115,2.120151889,233.1546987,233.1570302,Up,FA 15:4,S,233.15604,1.409,1370,[M-H]-,C15H22O2,FA,VYNPFWKAZJBFBM-UHFFFAOYSA-N,O=C(O)CC=CCC=CCC=CCC=CCC,68.6,75,233.15604:1564962 234.15939:274997 235.16275:28046,55.92381:2155 59.01267:4099 60.60311:1882 61.98721:2994 66.15343:2265 67.04697:2103 72.79204:2013 74.827:1905 75.18446:1954 83.04912:2633 92.9268:4416 94.92385:2280 112.25838:2345 120.08131:12591 132.71799:2539 190.01602:2832 218.09554:3090 232.06317:3112 233.15547:215996,233.15604,233.15604
M239T128,239.2027975,128.381,1.421130456,7.34E-05,0.688937839,NS,0.000495332,-0.537554276,4.134598837,neg,2.802289674,6.37569109,1.972977909,4.078228341,7.270136236,3.104457613,3.55113293,2.743022326,2.102225121,2.635347452,3.856936978,3.366535958,2.861895006,3.526580765,2.026768225,2.200442889,2.385964524,2.479762392,3.702362156,3.898537885,2.541594992,3.082088849,3.669516335,3.97330888,2.522206796,3.517310751,5.053634049,3.89452589,3.073612614,3.155985993,4.533693212,4.015348726,4.053401427,2.76673285,3.949378207,4.754722857,4.898072395,2.526527351,2.184929594,2.917493509,5.399402976,2.590232147,2.195555806,3.00878273,2.254550721,2.82773637,2.080020765,3.506405639,239.2016015,239.2039935,Ns,FA 15:1,S,239.20284,2.149,1419,[M-H]-,C15H28O2,FA,DJCQJZKZUCHHAL-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCCCC,35.3,75,239.20284:897710 240.20619:144413 241.20955:272421,58.51203:1891 59.01275:15610 61.98732:3658 62.8092:1997 91.02145:3051 93.39194:2374 152.26906:2734 154.06215:6544 184.0916:2148 195.13817:3279 223.02876:20986 224.02872:4726 239.20279:32309,239.20284,239.20284
M241T140,241.2184374,140.224,2.327320276,7.37E-14,0.347785517,Down,5.11E-12,-1.523730238,13.13252238,neg,1.407759323,3.459640865,1.083840583,4.389284525,3.410269364,1.294489029,3.240277599,1.439808205,0.973069971,1.169703463,3.99498995,3.718076202,1.424461516,3.324849428,1.017865499,1.356221961,1.061133877,1.070443285,3.60836076,4.35264647,1.187405732,3.066656862,3.736137606,4.297145077,1.448583499,1.149669375,2.960518607,3.250399107,1.381986052,1.282400349,1.141540088,4.636033066,3.867237191,1.584967044,3.984409151,5.581434337,1.203452077,1.282786916,2.551960002,1.284856258,1.296980634,1.351700277,1.325441532,1.398769463,1.036510711,2.649140699,1.314050977,3.481485483,241.2172313,241.2196435,Down,FA 15:0,D_NS,241.21854,2.342,1434,[M-H]-,C15H30O2,FA,WQEPLUUGTLDZJY-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCC,72,75,241.21854:3490939 242.22189:657479 243.22525:0,58.93689:2113 59.01262:8774 61.98728:3140 78.95815:6787 91.02112:2631 92.58489:2303 127.17355:2524 133.70207:2680 224.02982:10476 225.02667:10666 230.89291:2606 241.21849:470950,241.21854,241.21854
M241T160,241.2184909,159.816,1.573024659,3.70E-07,2.175319735,Up,4.76E-06,1.121227468,6.431783168,neg,5.424017772,1.99048378,4.17219167,3.279781725,2.837065833,7.098074053,2.333682799,9.328752125,9.690782993,11.20797012,2.488730191,4.243864386,9.317639395,2.397369468,3.882937621,4.925953155,5.66073332,10.92552451,2.191848727,3.513603126,5.016138681,2.469832939,2.7556468,4.042916173,6.889816551,6.871128296,1.892536317,3.329442226,7.717660911,12.34802189,4.705700735,2.893196365,2.364382437,3.451631237,3.860428298,4.008328453,5.57592582,7.067486972,3.041119952,3.121504955,5.681147857,6.102063993,3.034343977,3.775544056,4.855433464,1.93387351,3.26859316,2.359272484,241.2172848,241.219697,Up,FA 15:0,D,241.21854,2.673,1433,[M-H]-,C15H30O2,FA,WQEPLUUGTLDZJY-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCC,75,75,241.21858:5208893 242.22193:1044810 243.22529:80292,59.01269:9310 61.20108:1926 61.98731:3573 72.7896:2264 83.90034:2060 122.06935:2264 132.98083:2636 194.82704:2438 198.48152:2840 241.21858:284819,241.21854,241.21854
M247T74,247.1717757,73.9177,0.539345046,0.180032937,0.738124101,NS,0.275483257,-0.438064697,0.744648033,neg,3.073973828,2.961712247,0.99960849,10.93905613,3.85102511,5.740262745,2.67910481,2.172393818,2.38760141,2.729652537,1.745705838,2.436149728,5.383536783,4.172971578,1.3751481,2.528483284,4.981684136,2.26355186,1.732618232,12.32474226,2.047125569,1.954211807,4.397776025,4.850370265,2.644156782,9.182409177,2.823323146,2.542392431,3.068112416,4.500099158,1.698335242,2.790898129,1.647744237,1.369465721,6.151338133,4.089112395,2.219607155,3.50853073,1.410857987,2.639402108,2.974267753,2.730310759,1.324915445,2.254603166,1.639216787,2.077698906,1.085757221,1.183607777,247.1705399,247.1730116,Ns,FA 16:4,S,247.17198,1.235,1486,[M-H]-,C16H24O2,FA,IVTCJQZAGWTMBZ-UHFFFAOYSA-N,O=C(O)CCC=CCC=CCC=CCC=CCC,38.2,75,247.17198:273572 248.17533:66549 249.17869:18696,58.63068:1855 59.01276:13788 76.69067:2261 86.90638:2276 89.02351:7142 92.92673:3079 106.65733:2128 133.80917:2173 147.06093:2168 164.07173:4334 247.17154:7716,247.17198,247.17198
M249T88,249.1875814,88.0653,0.599401908,0.102914341,1.344223641,NS,0.176587409,0.426773182,0.987524101,neg,4.248507229,1.867412828,0.592594684,5.149589422,3.394327665,7.814328173,2.116192117,3.359474048,3.182804301,3.56297116,1.082489965,1.097811514,5.109767974,1.870130445,2.256038237,1.748685015,3.978260414,3.2573579,1.318560466,5.136770185,2.332933159,1.477746775,3.739918504,3.098197616,1.783952208,7.720575233,0.966568136,1.595075307,3.457036403,8.147254975,1.710411725,2.585095339,0.621827872,1.831007168,5.31191126,4.085881925,2.670349611,3.000261033,0.834895526,2.997272334,2.886279652,2.638118994,2.655902585,3.301008455,2.970126191,0.796684067,1.196619877,1.172934905,249.1863355,249.1888274,Ns,FA 16:3,S,249.18773,1.471,1502,[M-H]-,C16H26O2,FA,KBGYPXOSNDMZRV-UHFFFAOYSA-N,O=C(O)CCCCCC=CCC=CCC=CCC,41.1,75,249.18773:1108449 250.19108:197096 251.19444:39702,55.92461:2203 59.01271:18921 61.98714:6171 69.77111:2134 77.116:2108 91.64347:2623 116.97166:4439 121.10936:2673 155.20076:2597 167.03267:3146 175.80348:2404 177.16592:4497 192.08104:2884 193.50043:2570 205.16116:2914 219.08862:2629 231.17719:2726 232.18074:2827 233.32634:2637 247.17163:21423 248.17502:15053 249.15138:9749 249.18747:69790,249.18773,249.18773
M251T107,251.2031314,107.014,0.477019185,0.201362976,1.261857986,NS,0.300902026,0.335549553,0.696020378,neg,3.775971018,1.215897513,0.380796148,4.982405192,2.494952507,5.108547405,1.604879141,3.534038685,2.875195268,3.311634313,1.018304533,1.301167841,5.237241777,1.481393355,1.751736383,1.13908625,2.86906529,3.639263612,1.229228375,4.956839738,2.418618135,1.710023614,2.4221338,3.718318443,1.331312546,6.51224286,0.925252018,1.645897117,3.564022709,6.905405863,1.154565117,1.991050101,0.753103174,1.740475024,5.732827313,3.55577906,2.231861983,2.983264704,0.595973002,3.059272694,2.877404597,1.997757976,2.626578052,3.029918444,2.394721434,0.811139766,0.838010355,1.668431668,251.2018753,251.2043874,Ns,FA 16:2,S,251.2032,1.791,1518,[M-H]-,C16H28O2,FA,RVEKLXYYCHAMDF-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCC=CCCC,36.2,75,251.2032:2552234 252.20655:433296 253.20991:316537,59.01273:7418 59.92374:2399 61.98709:3132 71.22166:2382 89.02355:3804 93.98147:2234 97.71017:2839 129.49042:2187 131.41264:2372 201.30545:2287 209.15508:2768 234.11508:5468 250.14626:91165 251.15047:19923 251.20312:115869,251.2032,251.2032
M253T139,253.2185732,138.777,1.084885739,0.001017028,1.94351676,NS,0.00439544,0.958669549,2.992667033,neg,4.315202584,0.771041636,0.373068638,3.395490823,2.779428299,6.476629571,1.424285118,2.470643416,4.612083086,3.150556727,0.658388444,1.272967315,4.072471216,0.748073393,2.500557892,2.003465964,3.134777044,2.259083291,0.720034843,3.350238955,1.051345407,1.062714386,2.046311496,2.73895383,1.15401576,6.678819008,0.659436128,1.473918355,5.876043235,7.923623044,1.86887621,1.925252304,0.440288107,2.322739868,3.927752296,2.409414445,2.057284964,3.722391019,0.326100207,4.294310491,3.345343134,3.100829397,3.118281262,2.828122536,3.553157329,0.300075688,0.39166549,0.598613564,253.2173071,253.2198393,Up,FA 16:1,S,253.21863,2.322,1528,[M-H]-,C16H30O2,FA,SECPZKHBENQXJG-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCCCCC,75,75,253.21863:100036664 254.22198:19423882 255.22534:8328086,74.66103:17637 74.83866:16008 75.52913:15647 87.45117:15963 90.13727:15550 112.16663:15093 121.20763:17937 123.29658:17163 190.96872:17923 214.88416:14535 253.21875:6479246,253.21863,253.21863
M255T202_3,255.2340896,201.7255,0.361053103,0.391961128,0.952852625,NS,0.503284804,-0.069675002,0.406757001,neg,3.316488715,2.376225042,1.868824887,3.668705673,3.018853624,2.683039118,2.815549725,3.110713037,3.01826905,3.464661538,2.952437514,2.926012567,3.471053627,2.56310934,2.091723782,2.411127415,3.464116361,3.069537801,2.892169365,3.614673479,2.66321071,2.538632256,2.883242646,3.917276631,2.327644656,3.549620389,1.872233384,3.23116636,3.363464491,3.253742849,2.606328155,3.079086619,3.264263836,3.222435236,3.543160231,4.393988446,3.104255942,3.250708456,1.711633851,3.182905146,3.001769621,2.952245613,2.964811238,3.123873159,2.886466589,2.60049658,1.768615073,2.496145564,255.2328134,255.2353657,Ns,FA 16:0,S,255.23419,3.378,1547,[M-H]-,C16H32O2,FA,IPCSVZSSVZVIGE-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCC,75,75,255.23419:1379967360 256.23754:280201856 257.2409:22915724,55.9357:138259 61.20006:146425 64.61659:146105 87.54144:139349 97.77587:162085 105.14867:174834 107.94621:160916 140.02412:168179 163.81656:155213 189.28665:170954 230.06995:169215 237.22285:171663 255.23438:57225796,255.23419,255.23419
M265T127,265.2189744,126.6265,0.729786541,0.036874295,1.365908003,NS,0.078914843,0.449860318,1.433276275,neg,3.948779714,1.183880757,0.66992596,2.993328139,2.493988425,5.043015684,1.858625413,2.728983622,2.978672082,3.245668232,1.015075422,2.429138383,4.649663693,1.440252042,2.095402032,1.623026912,3.779962978,4.137924984,1.388008565,4.653056736,2.033226812,1.597901749,2.730555875,3.744966084,1.794088397,7.192598262,1.08337799,1.69117831,3.704163339,5.058172503,1.50914396,1.922068484,0.867189526,2.119171371,4.080115845,3.14148675,2.517819816,3.342535634,0.626654644,3.061600951,2.86172419,2.830842993,3.061253104,2.744166196,2.700559399,1.145461158,0.6430622,1.788294478,265.2176483,265.2203005,Ns,FA 17:2,S,265.21902,2.121,1624,[M-H]-,C17H30O2,FA,LEIXEEFBKOMCEQ-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCC=CCCCC,60.3,75,265.21902:387736 266.22237:68772 267.22573:35330,51.81022:1958 59.01271:4834 61.98721:4809 86.64802:2339 88.37421:2477 125.0426:2423 178.05144:4321 264.16235:7997 265.2186:49393,265.21902,265.21902
M267T173,267.2346452,172.7615,0.954640553,0.005175975,1.579930983,NS,0.016410911,0.659861538,2.286007856,neg,3.601505271,1.043282881,0.355202297,3.45104284,2.561313123,4.056653424,1.451802457,2.737550433,3.396023113,3.649363465,0.902137662,2.014448669,4.056851783,1.155548008,2.172362349,1.953325852,4.028429301,3.01234897,1.019925751,3.411786897,1.590932213,1.329020043,1.772217944,4.179744129,1.146526446,6.166399882,0.921277766,1.797197825,4.586194288,6.088622667,2.109777925,1.973103474,0.795051462,2.418897225,3.562373923,2.672738198,2.654058086,3.711697018,0.411337672,4.366851033,2.964195356,3.073764644,2.651355572,2.641981075,2.500911135,0.545108875,0.461971522,0.768498656,267.2333091,267.2359814,Ns,FA 17:1,S,267.23477,2.887,1636,[M-H]-,C17H32O2,FA,QSBYPNXLFMSGKH-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCCCCCC,71.6,75,267.23483:5388656 268.23818:1163612 269.24154:272255,56.48108:2315 59.01277:3329 67.53288:2180 80.94766:2498 90.97025:4781 111.97553:2217 120.20754:2211 132.98125:9679 156.86913:2712 186.95599:35879 231.91283:2844 267.23468:639207,267.23477,267.23477
M269T68,269.2140053,68.38155,0.397475999,0.36322214,1.046337382,NS,0.475181054,0.065348111,0.439827687,neg,4.02769103,3.071794805,3.555265957,4.252250167,3.98443498,5.252258464,3.046539346,4.688242965,3.295008106,4.128129599,4.186723762,2.521098642,4.278733008,3.821820027,4.518294017,3.984494092,3.620297438,3.691432671,4.210475382,4.265246035,4.073953676,3.451448588,3.869213871,3.953654889,3.443735855,4.118210269,2.863887931,4.741529734,3.695684692,4.187774371,3.78141518,3.452294517,4.534436481,4.009288407,4.454243302,3.557121244,5.407981434,3.77610541,3.516892512,3.690558558,4.658092341,4.440690835,3.858186443,2.015642396,2.887804382,2.907043211,3.222946338,3.82701732,269.2126592,269.2153514,Ns,FA 16:1;O,S,269.2142,1.153,1661,[M-H]-,C16H30O3,OxFA,DBPLZAFLPDHBAS-UHFFFAOYSA-N,O=C(O)CCCCCCC(O)C=CCCCCCC,59.1,75,269.2142:1443831 270.21755:217394 271.22091:1244045,55.97062:2129 57.03349:2334 59.01265:17098 61.9871:5771 71.04938:2654 89.02346:21218 92.9272:7240 94.92413:5536 98.95487:4647 99.08015:2868 104.03457:2568 116.20667:2984 161.14267:2375 171.1391:3569 186.95673:3399 203.47177:2562 225.22334:15003 226.98785:7565 227.98723:4699 251.20166:5381 252.95053:4648 253.21808:5682 266.96606:33473 267.96585:4649 268.94455:11578 269.21405:322678 269.24905:32951,269.2142,269.2142
M271T67,271.2296663,66.7504,2.075655433,1.79E-10,0.600015827,NS,5.08E-09,-0.736927539,9.747064075,neg,3.002101086,4.70073803,2.318688565,5.34776311,5.190045022,3.314610198,4.483620568,3.05826275,2.38535128,2.778204358,5.335988235,4.454442805,2.583572571,3.145304317,2.710193623,2.68525525,1.979222384,2.335710828,4.469827944,4.776870634,2.871015687,3.755367598,4.487682008,4.762666109,2.118551765,3.106518654,2.48344268,4.258286371,3.680436541,3.789737503,1.927207518,3.703870568,4.496980571,3.540332865,5.008861969,4.942691131,2.37678934,2.256836055,2.41069446,2.55625757,2.475999334,2.516021264,2.463218543,2.631216098,2.285627897,4.967963572,2.182781519,3.725746984,271.2283102,271.2310225,Down,FA 16:0;O,S,271.22992,1.112,1677,[M-H]-,C16H32O3,OxFA,KMEKMXBMYZGGDT-UHFFFAOYSA-N,O=C(O)CCCCCCC(O)CCCCCCCC,47.9,75,271.22983:1432478 272.23318:278670 273.23654:18639,50.98513:1788 56.24726:2349 56.82326:2456 57.03347:6321 58.71613:2054 59.01278:5065 68.27067:2450 75.92737:2456 83.04935:2476 89.02329:4247 92.92699:9222 94.92421:4213 107.933:2412 125.98212:2707 136.4503:2257 163.709:2644 209.19273:2567 211.20746:3393 225.22321:8400 228.98776:3586 229.16068:6615 253.21889:7319 266.96561:14616 267.96536:8854 268.9415:2972 269.2142:41028 269.24475:5170 270.21793:25728 271.22968:235260,271.22992,271.22992
M271T87,271.229825,87.24125,1.512285854,2.89E-05,0.731860518,NS,0.000223226,-0.450359376,4.539821918,neg,3.317498921,3.739251714,1.841733358,4.773548755,3.147337054,4.022447307,5.095314681,2.277785031,2.318016028,3.000403021,3.65882353,3.463989749,3.099480913,3.244793,1.92575487,2.300605841,2.697488314,2.429606569,3.264528339,4.524381832,3.04178905,2.852747122,2.63525265,4.184715022,2.688227679,2.566358645,2.886433471,2.373584888,3.611963794,3.161291901,2.071097541,4.198516402,3.443930582,3.098354713,4.40434123,4.487220759,3.059429926,2.781387055,2.132636276,3.263579268,2.356632168,2.126660342,2.064489845,2.619252379,2.344303549,2.88077987,2.168778675,3.341241238,271.2284688,271.2311811,Ns,FA 16:0(2OH),S,271.22998,1.45,1678,[M-H]-,C16H32O3,OxFA,JGHSBPIZNUXPLA-UHFFFAOYSA-N,O=C(O)C(O)CCCCCCCCCCCCCC,67.4,87.7,271.23001:1124789 272.23336:204449 273.23672:19369,57.03335:2164 59.0126:7202 61.9873:2906 62.65572:2081 64.35915:2449 71.04926:7015 76.86676:2410 92.92698:3504 93.58751:2210 102.78669:2454 104.90912:2772 113.68208:2366 131.75586:2698 197.19116:8407 198.19392:3538 205.77034:2535 223.20779:9319 225.22334:231074 226.22681:42717 245.19206:3121 252.20744:2512 253.21886:8500 269.21463:15731 269.25079:5769 270.21808:11097 270.2532:6484 271.22977:144162,271.22998,271.22998
M275T97,275.2034568,96.67275,0.537655901,0.13065995,1.44026507,NS,0.213675492,0.526334353,0.883857512,neg,3.377507765,1.490040851,0.755709395,5.96398459,2.608646655,4.983399422,1.240330926,1.833022848,2.696648393,3.160998357,0.774391077,0.941360462,4.673813829,1.016718702,1.987800119,2.202804259,4.6180623,3.023054794,0.923183779,5.864022541,1.753119646,1.236844683,6.324424925,3.001271532,2.313091377,13.11743902,1.122863779,1.387055771,3.519638856,8.549805155,1.396816625,1.972854631,0.452802312,1.336555566,3.454876992,2.909027632,1.319755984,4.616050777,0.771114385,3.307216389,2.956071162,3.635317671,1.514312564,1.831103742,2.092737951,0.699374756,1.998187308,0.923816796,275.2020808,275.2048328,Ns,FA 18:4,S,275.20361,1.611,1710,[M-H]-,C18H28O2,FA,JIWBIWFOSCKQMA-UHFFFAOYSA-N,O=C(O)CCCCC=CCC=CCC=CCC=CCC,45.5,75,275.20361:730662 276.20696:153911 277.21032:77484,53.45059:2048 53.96348:2402 56.83084:2314 57.23893:1907 59.00999:4059 59.01271:48205 69.46189:2139 69.92246:2543 86.61358:2716 108.04384:2276 141.01659:6019 150.94797:6478 164.67525:2647 192.95901:20248 192.9731:4183 194.95595:5183 231.21346:3314 275.20322:50507,275.20361,275.20361
M277T117,277.2189024,117.459,0.941227254,0.00495513,1.673152384,NS,0.015880015,0.742568846,2.30494498,neg,4.549864269,1.164844435,0.3119522,3.133309896,2.145453304,4.386225503,1.285212218,2.574442292,3.288315737,3.653206046,0.87406544,1.395962343,5.017823311,1.093267806,1.658213012,1.84512558,4.429130464,5.986793569,0.860583583,3.112917944,2.576696021,1.497066877,2.81845715,5.226484553,1.136017632,8.342139322,1.317864595,1.314521313,4.078062394,4.277550351,1.675459133,1.486048618,0.658626184,1.62228707,3.224278834,2.759520674,2.343824719,5.019132662,0.350751688,3.696282624,2.205241739,3.379727666,4.122949864,2.370688185,2.431223822,0.852767214,0.734690371,1.374083357,277.2175163,277.2202885,Ns,FA 18:3,S,277.21896,1.963,1721,[M-H]-,C18H30O2,FA,DTOSIQBPPRVQHS-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCC=CCC=CCC,74.2,75,277.21899:58066204 278.22234:12220840 279.2257:2357467,51.63887:11528 56.21313:13236 59.01262:87298 61.9873:25323 95.19536:12853 126.65634:14185 129.89143:12813 153.29398:14175 164.4238:15192 241.42035:14395 259.20996:18714 277.21902:1529632,277.21896,277.21896
M279T155,279.234288,154.655,0.751249784,0.034038719,1.401713469,NS,0.074084743,0.487191471,1.468026795,neg,4.523458399,1.122875787,0.293386795,3.288188383,2.196861363,3.717816837,1.681025949,4.035191602,3.682824417,3.934657959,1.08137922,1.611779775,5.11197683,1.423741188,1.662022016,1.327265793,3.608033296,4.485290898,1.045891983,3.173778828,2.446269431,1.985991736,2.603597596,5.134193675,0.979300848,5.577595199,1.247778522,1.479919914,3.56958772,3.781680381,1.661079435,1.890097243,0.839294611,2.323228641,4.622450628,3.535736267,2.6422628,4.275931706,0.319310715,4.196403068,2.670754761,2.54741319,3.41004538,2.911852796,2.748657567,0.861804453,0.464907511,1.422009895,279.2328918,279.2356842,Ns,FA 18:2,S,279.23444,2.588,1740,[M-H]-,C18H32O2,FA,OYHQOLUKZRVURQ-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCC=CCCCCC,75,75,279.23444:785465472 280.23779:152147504 281.24115:15393492,59.01269:28699 61.98721:22677 100.76553:18336 123.53336:14052 127.84263:16364 173.90399:14935 231.86104:18305 261.22449:21907 279.23471:2666207,279.23444,279.23444
M281T219_2,281.2499684,218.561,1.376090127,1.48E-05,2.083041296,Up,0.000127418,1.058691441,4.82828281,neg,4.554535535,1.018040897,0.291113152,2.669563202,1.634414474,4.69152906,1.235670784,3.599960286,3.622542573,4.475991851,0.995760324,1.464635381,4.584325167,1.0456023,2.600671528,2.351806835,4.316663736,3.921985533,0.805833772,2.620806196,2.071328932,1.45337819,1.730182691,3.531280928,0.975966116,5.2331338,0.844423123,1.416519691,4.849526441,4.796145941,2.491339811,1.421026005,0.732728445,2.352165123,3.299240687,2.738317168,2.874990778,4.989372272,0.413866264,6.185641778,2.982376615,2.931251207,3.915993594,3.150148957,2.889876454,0.427830177,0.507905546,0.675365096,281.2485621,281.2513746,Up,FA 18:1,S,281.25015,3.658,1767,[M-H]-,C18H34O2,FA,ZQPPMHVWECSIRJ-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCCCCCCC,75,75,281.25021:1223143040 282.25356:252695056 283.25692:26628736,53.12519:414610 56.90059:330184 255.46783:391452 280.24323:527200 281.25043:104828336,281.25015,281.25015
M283T318_2,283.2656326,318.4695,0.590272843,0.139454442,1.080296419,NS,0.225023766,0.111427223,0.855567647,neg,3.347626516,2.360915516,3.032298776,3.742153992,2.725546863,2.157715876,2.756142981,3.66747285,2.82784281,3.940375482,3.265445047,3.110192698,3.150954889,2.724196153,2.388085722,3.233951642,3.376045282,3.555242164,3.182305732,3.417956423,3.642957259,2.571807256,2.610403709,3.434240456,3.135434205,3.99721571,1.917523123,4.054668239,3.509484039,3.658382569,2.897546383,3.323896778,3.792546688,4.003769919,3.236277877,4.196516319,3.887009277,3.263633319,2.315671503,3.70913774,3.588714366,3.806960642,4.482677366,3.516077752,3.725119756,3.042819409,2.506207549,2.900668439,283.2642163,283.2670489,Ns,FA 18:0,S,283.26584,5.322,1790,[M-H]-,C18H36O2,FA,QIQXTHQIDYTFRH-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCC,75,75,283.26584:757245440 284.26919:165120912 285.27255:16093023,50.76439:361940 59.05856:323949 61.46305:347901 71.70251:339464 71.73641:353652 73.24585:409663 81.72865:402677 105.26884:410808 140.16238:432782 162.24658:428955 194.10854:392144 265.25613:640731 283.26605:70651608,283.26584,283.26584
M293T192,293.2506505,192.208,1.162409175,0.000341607,1.832534486,NS,0.001785206,0.873840348,3.466473335,neg,4.268430468,1.094640896,0.343216415,2.849719979,1.967811689,4.206986885,1.439411713,3.388636153,3.5074095,5.06020157,0.949760641,1.548824534,5.7556243,1.320816719,1.796932655,2.508254969,5.217880054,4.29443625,1.140794777,2.882407579,2.555883698,1.257281088,2.544538748,3.612460612,1.418590168,7.640057995,0.931173302,1.604865063,3.273208147,5.987505209,2.34760062,1.906369037,0.830775436,2.546145709,3.838144263,2.860436723,3.52448723,3.366034875,0.520131211,5.167473805,3.407231734,2.878772422,2.643355109,2.58240914,2.249600976,0.663831083,0.613764621,1.032884243,293.2491843,293.2521168,Up,FA 19:2,S,293.25085,3.218,1903,[M-H]-,C19H34O2,FA,BFXHARLBAGKNRH-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCC=CCCCCCC,22,75,293.25085:239600 294.2542:44486 295.25756:9447,56.75121:2301 58.87951:2098 59.0127:3013 61.98724:15140 69.23967:2243 69.94614:2142 71.01284:8210 71.87027:2227 76.41306:3039 78.12774:2451 81.93299:2471 82.03625:2256 93.05231:2578 98.26572:2501 120.40911:2541 192.11551:5247 193.16054:2598 203.778:2685 220.14766:41242 221.1555:86535 222.15833:13856 236.10649:60282 237.10959:13783 293.21765:5556 293.25046:67498,293.25085,293.25085
M295T292,295.2661541,291.6135,1.783817432,1.82E-09,2.79463468,Up,3.85E-08,1.482659703,8.739322142,neg,4.27626285,1.120287426,2.67184159,2.605804139,1.784471269,4.522749299,1.16172117,3.830674371,4.17233042,5.538500554,1.052925448,2.72102551,5.379770558,1.450101852,3.924057133,4.866675709,5.802065971,5.810104628,1.158969538,2.614366763,4.409180569,1.158335678,1.295813904,3.44648539,2.173814379,10.11144269,1.038909515,1.735822934,5.352030625,6.318803981,4.032032806,1.396775162,1.075803184,3.225153971,2.815300357,2.337513787,4.830942111,5.552176702,1.154596899,8.516030225,4.841658022,5.703749756,4.872994514,3.427627522,3.666625431,0.719426274,2.094574695,0.812722563,295.2646778,295.2676305,Up,FA 19:1,S,295.26639,4.876,1928,[M-H]-,C19H36O2,FA,YOKHLRHWEXTWJR-UHFFFAOYSA-N,O=C(O)CCCCCCCC=CCCCCCCCCC,50.9,75,295.26633:373228 296.26968:76155 297.27304:125944,52.1434:2131 55.8576:2063 59.01252:1974 61.50183:2303 61.98729:13424 61.98995:2362 62.1044:2247 62.72899:2089 70.64835:2242 108.67793:2622 136.2872:2208 220.14708:9313 221.15446:16634 222.15837:10850 223.16411:2507 236.1064:8264 237.10924:6650 260.23752:2760 295.22943:12133 295.26526:84811,295.26639,295.26639
M295T78,295.2298011,78.1438,0.833727951,0.02084718,1.328540853,NS,0.049936269,0.409842592,1.680952681,neg,3.65943642,2.395114176,2.506909311,2.368843478,2.469834417,4.462934858,4.819762904,2.889868543,5.062428938,3.558147222,1.855669801,2.153995381,5.353351266,3.112584688,4.508669657,3.989548108,6.316054488,4.310556858,2.128621609,4.256444301,5.598825657,2.018693131,6.456623388,2.791552091,4.459301153,8.735264366,1.667080919,5.263112147,6.096111162,7.363124987,2.752748498,3.961044303,1.868283413,2.35261317,5.299094914,5.289139449,4.66813445,3.3650189,1.948035291,4.500333262,4.886551152,2.603535159,3.338940508,3.141114064,7.058050372,3.825226269,3.299101887,2.014083266,295.228325,295.2312773,Ns,FA 18:2;O,S,295.23007,1.311,1924,[M-H]-,C18H32O3,OxFA,UKRXAPMQXXXXTD-UHFFFAOYSA-N,O=C(O)CCCCCCC(O)C=CCC=CCCCCC,34.2,75,295.23013:531968 296.23348:119300 297.23684:742940,57.03349:4570 59.01269:42816 59.34219:2237 61.98725:7435 77.79301:2541 83.01286:39781 90.47366:2479 92.04981:6553 92.92718:5162 94.92389:2773 116.97177:5863 119.94595:2868 125.98466:2552 141.12866:3402 149.01015:12335 167.1076:5074 176.07185:23234 220.14828:8064 221.15538:13502 222.15923:8832 236.10719:11060 237.11031:6708 258.14603:2643 264.98569:6035 277.21832:7321 278.22061:2859 279.23618:2866 281.01868:4383 295.22992:76051 295.2644:4273,295.23007,295.23007
M297T96,297.2455458,96.0272,0.653535936,0.081170607,1.193906169,NS,0.146120531,0.255689458,1.090601204,neg,3.176327621,3.210889445,4.90395544,2.38539416,1.876062189,3.787593167,4.364910652,4.776771167,4.112987353,3.260023807,3.184843231,4.587223563,4.115295146,2.045580408,1.151390949,2.809023513,2.732791023,5.245744176,1.916004107,2.524269145,3.163353964,2.602809636,2.557012627,4.74359843,5.885776065,3.322840664,1.808407806,1.955222482,4.672725476,3.03309736,5.416852637,5.722559323,3.303949285,2.218368492,3.230915399,3.514029782,3.200191362,4.269014854,2.667030236,3.586639074,3.249568709,5.018863682,3.484888594,3.296511416,1.479423856,2.355812846,2.704242548,2.381628807,297.2440596,297.247032,Ns,FA 18:1;O,S,297.2457,1.604,1945,[M-H]-,C18H34O3,OxFA,JEXIZLHRWZNJIX-UHFFFAOYSA-N,O=C(O)CCCCCCC(O)C=CCCCCCCCC,45.7,75,297.24576:1488619 298.24911:275042 299.25247:485038,57.00876:2383 59.0127:243922 60.016:2744 61.98716:11203 64.63393:2467 73.02837:8552 81.77155:2648 85.02296:2371 89.84837:2415 105.45435:2545 109.57436:2334 113.37011:2327 114.47523:2378 114.48315:2862 116.97166:2716 125.09619:3907 127.11245:3548 141.12892:3249 142.07129:2508 155.1436:3052 166.77444:2665 174.99257:82139 213.18726:3078 217.00394:191464 251.23888:9824 253.25653:15370 254.25899:2722 279.23422:7634 295.23038:5178 295.67001:2655 297.1543:10482 297.24548:368816,297.2457,297.2457
M299T83_2,299.2612132,82.7946,1.134826897,0.00121767,0.852348598,NS,0.005096523,-0.230484503,2.914470355,neg,3.693175595,3.184818981,2.25888902,3.43663588,3.455585791,4.128116072,3.535049609,3.329853453,2.129032988,3.165102751,3.459888954,3.202729835,3.425867007,3.550289692,2.588315554,3.157864526,2.635945492,2.632755125,3.681878666,3.345445597,3.694409883,3.382343446,3.307245771,3.274145618,2.626473725,4.240331636,2.960313276,5.05745277,3.450205569,3.582977742,2.814248154,3.941034648,3.94367406,2.919201044,3.70541053,4.403465619,3.082266707,2.727959024,2.164431234,2.894259142,3.031514221,2.914301903,3.559468155,2.99939953,2.857821459,3.283616284,2.167510863,3.013208992,299.2597169,299.2627095,Ns,FA 18:0;O,D,299.26144,1.388,1982,[M-H]-,C18H36O3,OxFA,RKHXDCVAPIMDMG-UHFFFAOYSA-N,O=C(O)CCCCCCCC(O)CCCCCCCCC,39.6,75,299.26144:1037073 300.26479:186737 301.26815:16873,50.59262:1864 50.70038:1862 51.9281:2006 55.87503:2352 57.0334:3483 59.01271:145539 60.01609:2331 94.73251:2365 94.92403:2889 119.9465:3309 132.98042:4028 144.59279:2430 145.87827:2556 171.10297:3207 174.99255:75080 175.99657:4244 207.79041:2742 217.00397:161096 218.00798:14326 253.25514:10076 262.71634:2848 279.2374:2832 281.25027:7681 282.99713:11864 283.99667:4513 297.24561:54737 298.24921:38569 299.26114:335500,299.26144,299.26144
M299T95,299.261129,95.28335,1.317402549,3.36E-05,0.74281906,NS,0.000255117,-0.428917261,4.473344139,neg,3.470245365,3.569430375,1.826544065,3.504712101,3.568982178,5.419966619,3.579710484,2.360942758,1.833374801,2.217045222,3.721332137,3.143737974,2.518055016,3.113749159,2.236989893,1.96575532,1.910930411,2.927239091,3.7044156,3.642528416,2.171816616,2.965721562,3.319919032,3.468225956,2.230357228,4.397719963,2.478979816,3.42563994,2.904875491,4.316185868,1.937520408,4.011424766,3.713591065,2.427735108,3.606690138,4.784902126,2.28776383,2.273114359,1.7583244,2.207340204,2.486636437,2.440598513,2.190736018,2.62882682,3.32709974,3.20599268,1.889669255,3.246400096,299.2596327,299.2626253,Ns,FA 18:0;O,D,299.26132,1.576,1981,[M-H]-,C18H36O3,OxFA,RKHXDCVAPIMDMG-UHFFFAOYSA-N,O=C(O)CCCCCCCC(O)CCCCCCCCC,20.2,75,299.26132:578370 300.26467:120254 301.26803:17695,59.01271:184174 60.01617:4835 61.01688:2414 61.98727:6876 63.23156:2293 73.02847:23279 76.23316:2416 87.31463:2713 92.92728:5591 132.98158:4239 137.31659:2626 174.99268:99356 175.99622:4096 206.28612:2670 217.004:197105 218.007:14486 219.00935:2793 227.8806:2907 235.73735:3011 251.23869:3430 253.25537:3663 272.14615:2946 281.24994:5513 282.99716:7295 297.24561:63629 298.24893:54170 299.26114:135015,299.26132,299.26132
M301T109,301.2192463,109.439,0.226101387,0.544772456,1.187206889,NS,0.645043335,0.247571369,0.263784859,neg,3.160896954,0.863283777,0.661073293,7.76056279,2.276645193,2.519686591,1.374798737,0.943770703,3.279976611,2.093002297,0.619028303,2.06889451,5.858603288,1.619675229,1.316791614,1.502070256,5.842036136,1.474327627,1.467477022,7.760025159,1.38695014,1.080012349,2.195232052,3.694041986,2.519635671,12.07337017,1.168299076,1.157878656,1.635439486,7.68323978,1.594902844,0.908690661,0.878390349,1.302652142,2.800609694,2.380357961,1.022408974,4.287997513,1.296183777,1.89220739,1.647665402,2.024935811,0.721461067,0.776321929,0.799044902,0.560064696,1.029241063,0.893102471,301.2177402,301.2207524,Ns,FA 20:5,D,301.21942,1.833,2001,[M-H]-,C20H30O2,FA,JAZBEHYOTPTENJ-UHFFFAOYSA-N,O=C(O)CCCC=CCC=CCC=CCC=CCC=CCC,17.5,75,301.21945:3588063 302.2228:860298 303.22616:235817,50.8511:2161 54.9275:2261 56.45775:2131 59.01272:63259 59.2948:2267 60.01631:5360 61.98725:37933 63.4973:2333 83.04939:2678 83.71576:2405 86.80396:2778 91.86847:2867 135.11813:3331 174.99257:4602 175.99562:3086 203.1813:7110 217.00449:3858 218.00719:7757 219.00877:3262 219.97771:3571 220.99635:4637 230.87157:2713 257.22919:10636 265.58765:3006 298.09451:3053 299.26212:14895 300.26407:7253 301.21906:20417,301.21942,301.21942
M301T180,301.2192634,180.095,0.294593061,0.401086467,1.19864366,NS,0.511788442,0.261402829,0.396761991,neg,0.064037341,0.074199877,0.080328358,0.091192959,0.075246793,0.058858001,0.068392938,0.068057459,0.06443489,0.053467239,0.055990369,0.073332555,0.096011401,0.090118572,0.051027776,0.060831367,0.110575994,0.071740834,0.095278138,0.105374053,0.13867622,0.114340239,0.149855399,0.101630501,0.061745934,0.133608993,0.053023344,0.13347028,0.381965252,0.091632509,0.075566011,0.101950575,0.065196782,0.051216874,0.097760329,0.080230762,0.114165363,0.106324999,0.077016815,0.054618371,0.062214758,0.52989961,0.049475908,0.06152294,0.12183647,0.083886866,0.062333326,0.049369582,301.2177573,301.2207695,Ns,FA 20:5,D,301.21957,2.994,2002,[M-H]-,C20H30O2,FA,JAZBEHYOTPTENJ-UHFFFAOYSA-N,O=C(O)CCCC=CCC=CCC=CCC=CCC=CCC,63.7,75,301.21957:677370 302.22292:140388 303.22628:241866,55.63894:2337 59.01272:39389 60.01597:5096 61.98724:81724 71.38835:2053 77.89055:2358 116.99823:3003 132.63663:2701 159.64009:2699 174.9921:5942 175.99596:4392 217.00372:9709 218.00679:13453 219.00772:3871 219.97876:20242 220.99762:3783 301.21933:263927,301.21957,301.21957
M303T141_1,303.2347258,140.9775,1.136541912,0.000858111,1.676825496,NS,0.00383075,0.745732558,3.066456386,neg,4.661345286,1.024144715,2.157214549,2.813478297,2.634582308,4.874314771,1.444339077,3.017858412,3.709714137,4.063537855,0.77099997,1.418760637,5.185344376,1.082143203,2.718030754,1.834829459,4.341873735,2.337810414,1.624449731,2.742720704,1.611057948,1.342908373,2.666348884,3.408711831,2.05589247,6.854692855,0.891154451,1.395673652,2.887035758,6.545581711,2.598744639,1.773805934,1.019719181,2.823116968,2.858770234,4.718991567,2.488686518,3.281352911,1.432610666,3.593201397,2.636344194,2.640961113,2.602172558,2.197675835,1.724221946,0.741958359,1.586184124,1.308685495,303.2332096,303.236242,Up,FA 20:4,D_NS,303.23486,2.363,2033,[M-H]-,C20H32O2,FA,HQPCSDADVLFHHO-UHFFFAOYSA-N,O=C(O)CCCCCCC=CCC=CCC=CCC=CCC,54.1,75,303.23495:27500968 304.2383:6964126 305.24166:663274,57.42839:22009 59.01273:533865 59.35199:21986 75.76804:23554 82.92252:24216 83.04965:34165 106.5489:24967 141.01646:45880 177.09148:28440 191.04132:26898 205.19647:56744 259.24551:136288 260.24713:29203 285.22708:34700 303.23495:714711,303.23486,303.23486
M303T238,303.2350816,238.358,0.537466307,0.157593121,0.904404927,NS,0.247934497,-0.144959243,0.802462744,neg,1.575940503,1.748767207,2.043830303,1.909466226,2.520580563,1.442732799,1.741750361,1.82901551,1.817877174,1.861259729,1.800682617,2.139274715,2.088950142,2.02955623,1.008273752,0.86675513,2.342623701,2.092554071,2.871468287,1.47960166,2.248145057,2.069178325,2.346672342,2.578637438,1.558916959,2.143540072,1.308460095,2.484820802,1.990264873,2.484752758,1.068553892,1.789097216,1.916184176,1.319139888,1.845237997,1.598829981,2.276290412,2.139327335,1.807568804,1.655383077,2.573608733,2.713366127,1.284043147,1.963216064,1.655385361,2.73533522,1.281782388,1.47056736,303.2335655,303.2365978,Ns,FA 20:4,D,303.23517,3.98,2034,[M-H]-,C20H32O2,FA,HQPCSDADVLFHHO-UHFFFAOYSA-N,O=C(O)CCCCCCC=CCC=CCC=CCC=CCC,39.1,75,303.23517:362606 304.23852:113239 305.24188:70656,50.08769:1911 51.53216:1943 54.83878:2227 59.01268:218898 61.9872:59947 61.99025:3825 63.28992:1885 64.48911:2130 68.3093:2282 74.29314:2009 99.88142:2348 130.59901:2858 141.01639:136406 219.97867:13475 220.99687:7397 254.99953:2424 303.2348:90098,303.23517,303.23517
M305T177,305.2506179,176.598,0.889043961,0.010798008,1.504084029,NS,0.02949813,0.588885168,1.966656347,neg,3.459718473,0.823744325,0.703784565,3.981741219,2.243695553,4.619732918,1.559660942,3.089042332,3.578360228,4.093989031,1.043871164,1.271243604,4.024059718,1.096294619,2.29502559,1.539878631,4.366903996,3.84444657,1.587840527,3.779645007,1.805994806,0.879830741,2.706139409,3.565425906,1.527513297,6.393986666,0.728221769,3.166055335,2.920314176,5.886101394,2.350378332,1.702662004,0.98334562,2.074538094,3.20166743,3.385202668,2.728204666,3.890601052,0.885209262,3.861508697,2.368391102,2.377091327,2.137295723,2.427274979,2.162998554,0.61351972,1.142426513,0.885244964,305.2490917,305.2521442,Ns,FA 20:3,D,305.25079,2.951,2075,[M-H]-,C20H34O2,FA,AHANXAKGNAKFSK-UHFFFAOYSA-N,O=C(O)CCCCCCCCCC=CCC=CCC=CCC,63,75,305.25079:6576276 306.25414:1514131 307.2575:173057,56.06074:2560 56.31754:2295 56.70527:2457 59.0127:283496 59.95935:2584 60.016:8237 61.9872:4800 63.29613:2318 85.45575:2768 87.38474:2789 106.97082:2967 141.01649:167356 142.02008:7898 148.97404:2866 151.37819:2824 187.96602:5290 208.94571:3679 223.11615:3230 303.23419:8969 304.2373:6820 305.25076:526879,305.25079,305.25079
M305T194,305.2506626,194.233,1.26021893,9.11E-05,2.072607301,Up,0.000593151,1.051446793,4.040584839,neg,4.197036358,0.746293322,1.144093442,2.878299168,2.182319022,6.487277142,0.199839649,3.30164699,3.396018897,3.983866182,0.722798062,1.30965454,4.431078405,1.091419279,2.493278847,2.015125536,4.401000468,3.024766002,1.344398358,2.801560336,1.883984596,1.096103056,2.586435969,2.667699463,1.634190676,6.980189522,0.717859874,2.017496724,3.345594766,8.928763636,2.204382338,1.525764872,0.581079776,2.340681667,2.686918461,3.40033125,2.521145049,4.161401233,1.13827663,4.189661432,2.609807261,2.51849019,2.898797469,2.860672656,2.687817938,0.752807846,1.340857401,0.782970548,305.2491363,305.2521888,Up,FA 20:3,D_NS,305.25092,3.249,2076,[M-H]-,C20H34O2,FA,AHANXAKGNAKFSK-UHFFFAOYSA-N,O=C(O)CCCCCCCCCC=CCC=CCC=CCC,40.2,75,305.25092:976857 306.25427:212705 307.25763:36270,50.46756:1996 57.77177:2085 59.0127:321372 60.01603:9109 61.98715:9109 68.25954:2157 69.9276:3102 80.87978:2867 83.04924:3760 87.34907:3090 115.80483:2862 123.91747:2408 125.02396:2399 133.25345:2365 141.01646:190463 142.01991:9404 184.84402:3216 208.75476:3275 287.24216:3921 303.23639:4078 305.25092:125153,305.25092,305.25092
M307T239,307.2663449,238.5785,1.246931986,0.000112193,1.889050183,NS,0.000705014,0.917661028,3.950032637,neg,4.255181298,1.013793636,0.417974152,2.480212129,1.721800211,4.522983748,1.625497975,3.977797598,3.104639654,4.682274616,1.006835078,1.251130003,4.916053373,1.208964657,2.093837901,2.181253701,3.629516029,4.409585488,1.369932951,2.549321361,2.396352552,1.098278963,1.882760995,3.235822862,1.216699183,6.594242083,0.850244953,1.705649112,4.0654725,4.921815547,1.980366025,1.772891809,0.904054316,2.765311087,4.066964381,2.962070676,3.251399315,4.521048349,0.626916798,5.975705665,2.739537322,2.283531987,2.833969902,3.106060526,2.414131659,0.63876416,0.683901664,0.900322397,307.2648086,307.2678813,Up,FA 20:2,S,307.26645,3.992,2088,[M-H]-,C20H36O2,FA,XSXIVVZCUAHUJO-UHFFFAOYSA-N,O=C(O)CCCCCCCCCC=CCC=CCCCCC,74.7,75,307.26645:11402825 308.2698:2611320 309.27316:302315,53.93618:2186 55.78217:2164 59.01276:19985 60.01596:5164 61.98724:37050 76.94044:2647 85.57449:2688 140.89017:2643 141.01648:5173 142.01953:3517 143.99112:3704 153.09804:2723 206.37123:3332 267.24814:3261 307.26645:507712,307.26645,307.26645
M311T372,311.2977837,372.408,0.896342006,0.006960965,1.231578252,NS,0.020753447,0.300508297,2.157330535,neg,3.261942558,3.132871832,3.024361808,3.173264953,2.733624242,3.805492103,3.053382603,3.443981047,3.123970425,4.477941451,2.888291716,2.721160189,4.956151731,3.308361632,3.087758261,4.31122428,4.651050306,4.837590714,3.497090348,3.437703021,4.347072364,2.15935841,3.238373869,4.011472419,2.769290164,7.094920444,2.597041519,2.475121787,4.531320941,4.225172639,3.391408593,4.205370913,3.804381479,3.083033219,3.050910014,3.912481234,4.250992252,3.224116171,1.421249726,4.433548324,4.55407707,4.742127585,2.530027525,2.624617821,3.153197215,1.911203771,2.585528934,2.133017695,311.2962272,311.2993402,Ns,FA 20:0,S,311.298,6.219,2137,[M-H]-,C20H40O2,FA,VKOBVWXKNCXXDE-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCC,63.5,75,311.298:896961 312.30135:205480 313.30471:28960,54.94287:2208 59.58054:2387 60.07436:2118 61.25327:2062 61.98729:5634 62.92493:2214 87.24869:2191 91.02104:2803 178.53311:2329 284.0069:2803 309.28168:6714 310.28439:5414 311.29764:92402,311.298,311.298
M317T67,317.2143012,67.0532,1.22189641,0.000157497,0.598039662,NS,0.000926537,-0.741686927,3.802728534,neg,0.123587602,0.172747968,0.026520902,0.154345323,0.123585787,0.094352708,0.074680507,0.066374022,0.097314463,0.099500235,0.066486888,0.134371518,0.175799855,0.142609515,0.007560553,0.034295753,0.118294447,0.025043795,0.142546271,0.160464409,0.040387163,0.12774975,0.110923688,0.198826627,0.051327631,0.306578386,0.105048694,0.178538422,0.091224238,0.142722623,0.072785413,0.152631603,0.174136927,0.098548516,0.148008501,0.202923666,0.05020114,0.117798668,0.109993711,0.115790234,0.065080194,0.064195523,0.026556039,0.055294142,0.01101166,0.157457832,0.10605002,0.131484728,317.2127151,317.2158872,Down,FA 20:5;O,D_NS,317.21451,1.112,2185,[M-H]-,C20H30O3,OxFA,KONMRYXTSAJFFW-UHFFFAOYSA-N,O=C(O)CCCC=CC(O)C=CCC=CCC=CCC=CCC,43.8,75,317.21451:595280 318.21786:127230 319.22122:49625,51.27725:2178 57.0335:2535 57.90081:2095 59.01271:11524 61.98714:8062 62.24956:2074 66.68433:2149 67.41495:2291 90.32201:2384 92.92728:12869 93.03371:4241 94.92424:19751 119.94644:3325 154.06216:4550 159.8942:2763 176.04459:3823 204.82565:2870 237.15054:2933 290.07391:2420 299.20377:53379 300.20752:10165 315.19879:14639 315.25583:15055 316.202:10600 316.26007:12890 317.21442:193067,317.21451,317.21451
M317T85,317.2142901,84.9877,0.937752239,0.003437072,0.560902544,NS,0.011794027,-0.834177968,2.463811314,neg,0.081961116,0.116974365,0.212080337,0.134504111,0.152206673,0.085480737,0.167073557,0.074477311,0.046017546,0.044097406,0.175979398,0.132862269,0.078191239,0.14942301,0.028601494,0.02640608,0.031633289,0.072348196,0.156182728,0.198092644,0.033068298,0.148739943,0.104213221,0.149051218,0.033077785,0.101089352,0.112608346,0.16663814,0.081634377,0.097829734,0.0173454,0.179669379,0.196727041,0.055763587,0.114680827,0.190674326,0.080792216,0.068500397,0.039982495,0.07223116,0.101034375,0.075245935,0.008159867,0.056788638,0.080220184,0.147512863,0.588164107,0.127111364,317.212704,317.2158762,Ns,FA 20:5;O,D,317.21463,1.416,2186,[M-H]-,C20H30O3,OxFA,KONMRYXTSAJFFW-UHFFFAOYSA-N,O=C(O)CCCC=CC(O)C=CCC=CCC=CCC=CCC,44.7,75,317.21466:300726 318.21801:73405 319.22137:17476,57.03337:3788 59.01262:7182 61.9875:5753 63.51881:2182 69.27168:2223 80.07152:2385 92.92726:4369 94.92416:8832 145.99222:2578 164.23126:2346 216.93948:2696 245.19257:44237 246.19537:7784 255.17706:3322 273.18881:12282 273.21811:2973 274.19064:3355 299.203:3263 317.21439:103421,317.21463,317.21463
M323T378,323.2977782,377.537,2.003935127,6.05E-08,0.461564241,Down,9.13E-07,-1.115396637,7.21799478,neg,2.545675352,5.253277948,2.179023295,5.110134134,5.025741554,1.467844778,2.693778498,2.867650196,1.543702213,2.594117624,5.472367007,4.414601482,2.140969988,4.976435226,1.480511004,1.701114621,2.453358063,1.803717589,5.814958389,0.688070173,2.604305631,4.095057774,5.409447844,2.623225826,2.08438758,2.353557544,3.888208057,6.016351019,2.778152949,2.547173964,2.931310873,5.580880588,6.073979007,1.328800428,4.981005244,6.391078339,2.514577799,1.613541545,2.020068251,1.747089634,2.656783451,2.123638448,3.379352791,1.849272671,1.614695801,4.735547873,2.176863714,5.312042923,323.2961617,323.2993947,Down,FA 21:1,S,323.29803,6.296,2234,[M-H]-,C21H40O2,FA,HMQNHJJIYIZSOU-UHFFFAOYSA-N,O=C(O)CCCCCCCCCC=CCCCCCCCCC,66.6,75,323.29803:222870 324.30138:53729 325.30474:23524,59.01279:3649 61.98732:4117 71.16293:2030 80.4856:2682 86.87882:2486 111.838:2749 158.00061:2582 247.655:2693 323.29749:34068,323.29803,323.29803
M325T82,325.18632,82.4322,0.821277962,0.011732089,1.66209451,NS,0.031457901,0.733002419,1.930624643,neg,2.244169394,1.643873946,3.525155721,1.879398989,2.961573792,6.501940741,1.975183452,6.354730631,1.595362705,5.795040808,2.893696662,3.391936125,4.784732738,2.64291531,16.58371758,3.21125842,6.958235855,1.793031725,4.023663908,1.178659589,11.78818617,1.786335979,6.368608281,3.362305536,5.523466531,2.2120929,1.007674263,4.979398777,1.842211599,4.489564625,12.47135748,2.651307417,2.693754322,2.834790269,5.412853249,4.219884265,6.769360747,5.668527627,2.162270202,3.200875719,1.80864128,3.789545884,11.749845,3.076825076,6.116722684,4.93387942,1.829930529,3.029563124,325.184694,325.1879459,Ns,Dodecylbenzenesulfonic acid,S,325.18649,1.374,2247,[M-H]-,C18H30O3S,Others,KWXICGTUELOLSQ-UHFFFAOYSA-N,CCCCCCCCCCCCC1=CC=C(C=C1)S(O)(=O)=O,75.6,73.2,325.18634:27480934 326.18969:6586440 327.19305:2038485,50.10413:16065 55.39828:16429 57.52234:16753 59.74626:20212 61.10256:19320 79.95658:70231 117.01992:42378 119.04949:66485 166.12686:19430 170.0041:152497 171.00717:22662 183.01228:3530410 184.01569:312972 185.00793:66426 196.45216:18515 197.02856:154056 198.03528:64597 209.4118:19695 216.00879:28279 225.05986:60306 226.06502:33463 239.07509:70885 240.08127:30265 253.09174:31248 261.2233:32215 325.18658:10298089,325.18649,325.18649
M327T122,327.2350977,121.73,0.274873092,0.486311736,0.840147222,NS,0.593390436,-0.251285937,0.313085249,neg,2.352310925,1.510793616,0.541068843,9.499427893,2.649386505,3.313714356,1.762369339,1.665492834,2.802303258,2.293975929,1.211177146,2.358189135,4.346019581,2.314554746,1.571847534,1.157911276,4.379517867,1.367234549,2.171812282,9.420838917,1.244359311,1.249907794,2.097269692,4.244100068,2.139891738,8.78714998,1.236407921,1.865959849,2.353456395,5.43892523,1.390456749,2.335292344,1.173453438,1.934150414,4.306176406,3.563726114,1.767738524,2.902189933,1.122818678,2.881932255,2.069874287,1.526014984,1.843658052,1.462816082,1.113466761,0.647053796,0.699523057,0.894153726,327.2334615,327.2367339,Ns,FA 22:6,S,327.2352,2.039,2264,[M-H]-,C22H32O2,FA,MBMBGCFOFBJSGT-UHFFFAOYSA-N,O=C(O)CCC=CCC=CCC=CCC=CCC=CCC=CCC,16.3,75,327.2352:25325880 328.23855:7180645 329.24191:822560,59.01272:56434 61.98728:4662 107.08526:4185 135.11723:3345 227.20284:11786 283.24451:15010 284.24927:4285 325.18723:4584 327.23553:8938,327.2352,327.2352
M329T153,329.2507074,153.3655,0.535206287,0.140291881,1.387064231,NS,0.22613756,0.472034596,0.852967462,neg,4.040099254,0.536937076,0.416831909,5.385465075,3.024793535,3.981583558,1.400795623,1.936042985,2.998102834,3.798054133,0.559076341,2.117463254,3.799867354,1.238753829,1.176520387,1.333951228,6.56949236,3.012438179,1.00698936,6.123682912,1.278131504,0.997750514,2.054662813,4.5278409,1.477097807,8.189951139,0.968734879,1.133134643,3.922087206,4.110935256,2.171679717,1.018697406,0.585924229,1.580923751,2.57522864,2.890115665,2.087461659,4.339544894,0.656209068,3.548073773,1.923683821,2.278172057,2.20020994,1.259252629,1.256140457,0.32091874,0.776567779,0.731500834,329.2490612,329.2523537,Ns,FA 22:5,S,329.25073,2.554,2282,[M-H]-,C22H34O2,FA,YUFFSWGQGVEMMI-UHFFFAOYSA-N,O=C(O)CCCCCC=CCC=CCC=CCC=CCC=CCC,46.4,75,329.25089:7714076 330.25424:2014861 331.2576:304512,55.29603:3634 59.01271:75240 65.35782:3698 74.09:3402 74.75883:3723 74.96889:3836 83.04928:5722 84.24658:3793 102.56355:4441 177.16576:4354 183.89192:4469 231.21425:5079 285.26123:19139 329.25104:45284 329.28638:6076 329.71979:5360,329.25073,329.25073
M335T354,335.2980225,353.6015,1.22677845,0.000101272,2.105196118,Up,0.000646566,1.07395464,3.994511528,neg,3.424053169,1.072313473,0.439765129,2.43843246,1.651806564,4.008795442,1.982657719,5.230122135,2.366711585,3.067762592,1.220645687,1.075059187,4.819407579,1.475565649,2.409458011,4.715628897,2.55819523,3.398813932,1.061710452,2.131065422,2.216232623,1.178881188,1.650174531,2.328161115,1.222999582,9.184007365,1.022433428,1.406191669,3.448025788,3.119209209,1.608912008,1.677769717,1.009053771,2.286458555,2.970896338,2.177436319,2.511145606,4.830121706,0.935381368,7.669005079,2.348869414,3.41926755,4.882974248,2.812849671,2.316248261,0.790620079,0.692911653,0.87517818,335.296346,335.299699,Up,FA 22:2,S,335.29828,5.904,2320,[M-H]-,C22H40O2,FA,HVGRZDASOHMCSK-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCC=CCC=CCCCCC,68.5,75,335.29831:410790 336.30166:107908 337.30502:24389,59.01276:5988 61.9872:5507 63.12532:2323 87.242:3178 95.30399:2542 125.37585:2523 133.53723:2744 170.97787:3129 255.23482:7030 335.25778:5146 335.2981:97551,335.29828,335.29828
M339T96,339.2021072,95.623,0.718772099,0.030637991,1.480283754,NS,0.068055976,0.565873751,1.513739713,neg,2.30487996,1.876500671,3.343175272,2.104387034,2.738409867,5.424969341,2.190138719,6.000791263,1.52745906,5.444055377,3.059588686,3.657037437,4.435312321,2.564319598,14.09585349,3.053710049,6.519448538,1.823822148,4.165229302,1.276811882,10.752069,1.907746321,6.383455644,3.530139369,4.95320866,2.244799524,1.039678581,5.051817553,1.79712878,4.238302915,11.53007464,2.642162641,2.988776181,2.721239072,5.678357303,4.4802786,6.134582766,5.097720469,2.162353862,2.983634929,1.727631903,3.746074834,10.17300183,2.916909938,6.012138431,4.62551553,1.805664498,3.167130066,339.2004112,339.2038032,Ns,Norethisterone acetate,S,339.2023,1.597,2353,[M-H]-,C22H28O3,Others,IMONTRJLAWHYGT-ZCPXKWAGSA-N,CC(=O)O[C@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C#C,80.1,78.7,339.2023:15920843 340.20565:3514787 341.20901:1086582,52.93396:18385 60.49237:13932 77.97473:18878 79.95671:50425 92.92677:23808 96.95926:24460 112.73061:17300 119.04971:50924 121.42174:21642 126.33455:34119 149.13994:17922 170.0043:134510 183.01231:3166684 184.0159:276867 185.00769:49423 197.02878:70715 198.03531:34659 225.06017:63132 239.07547:63785 253.09175:20093 275.23923:33978 277.35089:17946 338.20862:21403 339.20221:7759844,339.2023,339.2023
M367T613,367.3606524,612.6975,0.68955169,0.039926052,1.296439336,NS,0.083916624,0.3745547,1.398743628,neg,2.593374051,2.178032158,3.590033006,2.102690158,0.68559157,3.778443259,2.074109045,2.380534428,3.179175248,3.91788949,1.618103798,3.419492517,2.624011262,2.415245416,0.961238307,5.780662406,3.114641301,2.924600505,1.969882007,2.048974795,2.859299006,3.182519483,4.115069043,3.442618289,3.005348095,1.622531369,2.466447864,1.912460783,6.513552683,1.449247639,1.18610396,1.892204746,2.292320689,4.3492166,1.297362771,3.473648894,4.090582507,4.044808992,5.503171637,6.345438812,1.309122871,2.459551074,1.523069376,3.007057048,1.963678621,3.329946104,3.233058922,3.289175689,367.3588156,367.3624892,Ns,FA 24:0,S,367.3609,10.226,2667,[M-H]-,C24H48O2,FA,QZZGJDVWLFXDLK-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCC,59.6,75,367.3609:434453 368.36425:134729 369.36761:13055,55.3372:2270 59.01258:15973 61.98715:13424 64.9911:2390 72.02049:2507 76.52964:2196 81.49884:2567 174.9924:12562 202.98779:20273 203.02867:2830 203.54861:2661 205.14697:3448 217.0033:21709 334.29669:2796 362.84863:2659 367.36044:154897,367.3609,367.3609
M381T684,381.3761485,683.962,2.109774376,8.98E-11,0.423335136,Down,2.91E-09,-1.24012786,10.04659052,neg,1.755010869,4.233551508,1.772648478,4.194054824,3.850378804,1.812139461,4.233611799,3.459387898,1.413266268,1.853059888,5.430132843,3.269296493,2.249665779,3.733267875,2.068579328,1.938280447,1.486669844,1.486887083,4.121735594,4.365160231,2.871083606,3.197291856,5.160726149,5.791420467,2.037401078,1.714990526,2.742558458,5.402529353,1.912784445,1.778851034,1.782176228,6.381173471,5.32174781,2.173982797,4.553869132,5.207537174,2.10060669,1.79945962,2.060662215,0.614957858,3.115945861,2.214792518,1.162614093,0.672781708,0.784696094,3.256695602,1.731507468,2.996458218,381.3742416,381.3780554,Down,FA 25:0,S,381.37659,11.41,2876,[M-H]-,C25H50O2,FA,MWMPEAHGUXCSMY-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCC,42.3,75,381.37659:443049 382.37994:119997 383.3833:11560,54.50735:2442 58.62384:2794 59.01267:69989 60.01628:2707 62.37753:2485 63.96208:2624 69.79782:2526 77.79123:2409 93.54375:2434 124.21774:2455 174.99258:33991 208.244:3031 217.00389:141706 218.00681:10454 381.37646:136413,381.37659,381.37659
M393T646,393.3765699,646.46,0.675572412,0.05832296,1.289693648,NS,0.112818203,0.367028411,1.234160446,neg,4.944029442,2.487629143,2.663073971,2.944972771,0.949342941,4.104782695,2.0921631,3.276793038,2.538941735,6.484413405,1.882808862,2.265460965,3.146092689,3.279620618,2.422727624,4.465825478,2.618865041,5.061187209,1.801042275,4.09865119,2.08399531,1.794339307,4.290953379,4.834014193,2.986550276,2.363019995,1.790828461,1.053406695,3.571383361,1.477978351,1.163412785,1.398538904,2.370141518,2.455996648,1.538298941,2.050790148,2.629333134,3.576564817,6.910575959,3.200314557,1.131981129,1.740011325,1.332197091,4.003800314,2.501677886,2.68173107,2.478880489,2.764673607,393.374603,393.3785368,Ns,FA 26:1,S,393.37683,10.789,3064,[M-H]-,C26H50O2,FA,ALQCJXNGZHBRNR-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCC=CCCCCCCCCCC,73,75,393.37686:580900 394.38021:164364 395.38357:126194,59.0127:101038 60.01583:4677 61.01693:3702 61.9872:14798 63.57195:2726 64.10163:2318 73.96006:2822 79.41486:2877 100.95165:2543 115.27156:3158 143.41095:2486 144.38364:2655 146.96564:4487 190.98753:3015 304.27158:2698 393.37674:258583,393.37683,393.37683
M395T633,395.391955,633.1575,2.362504937,4.67E-13,0.201222293,Down,2.53E-11,-2.313137949,12.33062781,neg,1.267423077,5.086224968,0.662522662,6.221186578,6.123431119,1.14704955,5.169916578,1.346750379,1.177575692,1.120204943,3.437927377,5.279401854,0.932531786,4.919429014,0.618224793,0.727865037,0.80284956,0.775417126,6.787185149,5.813320608,1.170308509,2.894810918,5.597754494,6.003960447,0.837836,0.763058338,3.872186964,5.922658404,1.135590626,1.259305056,0.746002865,3.754617277,4.876729227,1.407962861,3.931653978,4.737591766,0.803429404,1.130834489,1.236349465,0.709926128,1.272467875,0.825631582,0.707434264,1.246533787,1.097647375,3.549460867,0.864179908,4.678014931,395.3899781,395.393932,Down,FA 26:0,D_NS,395.39215,10.544,3089,[M-H]-,C26H52O2,FA,XMHIUKTWLZUKEX-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCC,55.6,75,395.39215:524738 396.3955:172747 397.39886:12832,52.22704:2022 59.01274:24780 61.98716:9148 74.01724:2846 74.02334:3488 75.98679:2434 100.94879:2479 118.0965:2657 217.00415:6692 252.99472:2993 263.58234:2728 280.92694:2693 294.13745:2687 393.37912:13100 394.37912:16636 395.39215:121362,395.39215,395.39215
M395T732,395.3919434,731.836,0.643448721,0.114114651,0.819954048,NS,0.19161492,-0.286385034,0.942658594,neg,5.176876663,2.029118903,4.218401137,4.053521105,3.30781314,2.693711258,8.944189744,3.453744936,4.747547928,2.450005975,3.096325156,3.788250854,2.999711207,2.847961926,2.545042111,4.855228262,2.437205722,2.950199059,3.646485031,3.421266861,3.369593174,2.626468112,2.807024451,4.335478776,2.60884499,3.047644141,6.341736852,3.599703719,2.846660862,3.296790749,1.969998098,2.439315454,3.809987196,3.741661221,2.864946117,2.99684006,2.651690994,2.836709383,2.357971881,2.533598332,2.641218523,2.290497126,3.149437282,3.260114265,5.471843698,7.665296197,2.943655212,3.384039047,395.3899664,395.3939203,Ns,FA 26:0,D,395.39224,12.213,3091,[M-H]-,C26H52O2,FA,XMHIUKTWLZUKEX-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCC,69.5,75,395.39224:170443 396.39559:52215 397.39895:0,52.37814:2124 59.01265:8571 61.60027:2432 62.84531:2268 65.103:2309 66.56169:2419 68.549:2427 68.62399:2439 75.55219:2688 87.22093:2708 108.38017:2692 175.48669:2802 217.00314:4172 395.39255:53800,395.39224,395.39224
M397T324,397.3712443,324.307,0.354506984,0.299142328,1.165532299,NS,0.409449673,0.220988985,0.524122131,neg,2.835818098,2.122318473,2.161749739,2.058427886,0.384734762,2.823166779,1.913071609,2.408678816,3.680068344,1.663032456,1.396482775,2.442925327,1.776026143,2.646316325,0.915601157,3.222264307,4.660637671,1.529622319,2.31456436,2.035689465,2.780924826,3.138195249,2.720382487,2.44083616,1.521546939,1.889313533,1.772657226,1.490493852,5.359753491,0.60301338,1.255262564,2.220339214,3.856461115,1.221899019,0.521687354,3.0815297,3.962396108,3.457485149,4.846286667,7.304489603,0.907770412,3.383866859,1.359713054,2.162267417,2.991736651,4.198357183,1.874546816,2.937286821,397.3692575,397.3732312,Ns,FA 25:0;O,S,397.37137,5.42,3116,[M-H]-,C25H50O3,OxFA,TXJQWKHDXOCYEZ-UHFFFAOYSA-N,O=C(O)CCCCCCCC(O)CCCCCCCCCCCCCCCC,63.3,75,397.37161:920314 398.37496:244072 399.37832:38943,59.01273:6635 61.9871:3421 62.59549:2556 69.891:3257 83.61681:2783 89.02348:4068 103.41721:2544 127.8497:2551 137.84343:2708 141.12834:6782 180.89035:2958 194.80106:3027 217.00404:2990 283.26541:13515 284.27051:10674 379.36115:3449 395.35165:3165 397.37253:178629,397.37137,397.37137
M407T632,407.3921507,632.026,2.204853367,1.32E-10,0.364410014,Down,3.97E-09,-1.456365491,9.878908863,neg,1.393809508,3.288439168,0.90899946,4.971290494,4.396164973,1.734644587,3.414939653,1.56413663,1.003995524,1.803456622,4.957589215,3.095814514,1.592717536,3.440049857,1.033850106,1.368909457,1.158335831,1.101420277,3.256414053,3.94205949,1.790866172,2.905484679,2.697756819,4.71954882,1.91106901,1.237611887,2.595680641,4.145821207,1.296959458,1.345870395,0.90393473,5.552474194,5.467306955,1.525135781,2.925697564,4.695763835,1.225622222,1.210725808,2.198209583,1.590279649,1.980949277,1.416306602,1.019379094,1.442018994,0.98421918,4.090243981,1.748394441,2.850003511,407.3901137,407.3941877,Down,FA 27:1,S,407.39258,10.537,3212,[M-H]-,C27H52O2,FA,YHBCVFZBXDMZOC-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCC=CCCCCCCCCCC,73.6,75,407.39258:312373 408.39593:101412 409.39929:67288,59.01282:15867 67.75074:2482 69.89908:2399 80.84613:2613 160.48869:2577 407.392:51936,407.39258,407.39258
M409T488,409.3142762,488.0475,2.439919559,1.42E-16,0.219831617,Down,2.94E-14,-2.185529198,15.84771653,neg,0.280187017,1.275355801,0.352095422,1.58486623,1.423657945,0.2703409,1.27819668,0.337398401,0.239821308,0.349325988,1.540454427,1.31406376,0.287712082,1.336936451,0.284832907,0.2926774,0.280054399,0.269851145,1.581531144,1.518198,0.371430696,1.179756727,1.283925867,1.331049326,0.309537285,0.365175681,0.987116341,1.667222075,0.28215746,0.30481157,0.294795438,1.611684103,1.748355765,0.322885189,1.307602913,1.760084674,0.395416343,0.26266376,0.246594053,0.263265729,0.393922923,0.45876856,0.28805044,0.299486118,0.333588243,1.265456904,0.276342088,1.31572681,409.3122296,409.3163227,Down,FA 28:7,S,409.31445,8.124,3225,[M-H]-,C28H42O2,FA,HVSUZLSWJNESIE-UHFFFAOYSA-N,O=C(O)CCCCCC=CCC=CCC=CCC=CCC=CCC=CCC=CCC,72.5,75,409.31445:2514883 410.3178:826656 411.32116:113132,50.91794:2503 52.15905:2229 59.01258:7886 59.53815:2205 60.83616:2216 60.99187:2917 61.98715:4641 73.2027:2427 74.46657:2275 74.85675:3040 86.60182:3064 91.78699:2500 93.07257:2759 108.559:4405 138.33098:3279 141.01654:6305 160.58658:2639 202.79881:2751 338.75638:3064 353.25006:4153 389.20209:3293 394.28268:2784 409.31412:321252,409.31445,409.31445
M409T756,409.407857,756.458,1.780439747,9.92E-07,0.566707051,NS,1.16E-05,-0.819324942,6.003465332,neg,1.877779666,3.659229836,1.526306867,2.96620771,4.608583239,2.16270995,4.798341859,2.610082247,2.378336148,1.977336579,2.923392468,4.2919301,2.538127581,4.852640488,1.496979696,2.400902795,2.50943892,2.714419983,4.647705861,5.356522769,2.305726524,4.412367125,2.638716439,3.008673583,2.291338329,3.186611288,3.760864146,2.415131592,1.476187185,2.049865225,1.591288598,5.48461534,5.548331125,2.524483896,4.066222139,6.302601475,3.892267493,1.980951169,2.17999832,2.012926096,3.336448548,3.768946285,2.018395551,2.285151688,2.586062012,2.164635463,1.451037403,4.184209247,409.40581,409.409904,Down,FA 27:0,S,409.40802,12.617,3234,[M-H]-,C27H54O2,FA,VXZBFBRLRNDJCS-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCC,71.2,75,409.40802:340716 410.41137:109376 411.41473:22289,70.30826:2381 70.49503:2250 87.69238:3014 99.90934:2935 149.20688:2765 336.79764:3228 409.40784:83009,409.40802,409.40802
M411T416,411.3875028,415.992,0.046404303,0.908132984,1.017859658,NS,0.937098952,0.025538657,0.04185055,neg,2.313791071,2.802995564,2.575126687,2.359479049,0.269426169,2.809563732,1.84283662,1.928866823,2.49099963,1.294799355,1.603681294,3.175713552,1.60284669,3.212562733,0.811867318,3.247532595,4.489902122,1.446614175,2.64524121,2.077097748,4.242326529,3.359200429,2.239279115,3.398172728,1.996377198,1.56373502,2.124081971,1.592447935,4.167510558,0.437757359,1.210828568,1.860438367,5.147562921,1.208126394,0.365247193,2.445335045,4.29830732,2.844217725,6.078013532,6.187013854,0.965331195,3.251601164,1.501123919,1.863423156,2.368529877,4.663289386,2.900721193,3.41007001,411.3854459,411.3895598,Ns,FA 26:0;O,S,411.38782,6.945,3249,[M-H]-,C26H52O3,OxFA,UTAVPUZURYSXRI-UHFFFAOYSA-N,O=C(O)CCCCCCCC(O)CCCCCCCCCCCCCCCCC,66.4,75,411.38782:320654 412.39117:112513 413.39453:12803,58.41872:2486 58.64899:2390 59.01004:3469 59.01273:45042 61.98704:5301 67.30648:3012 80.83855:2566 98.14764:3346 101.31274:2777 110.98907:3168 133.51938:2736 141.01637:7817 149.19855:2664 246.98199:4273 393.37704:5244 411.38705:111437,411.38782,411.38782
M423T663,423.4236394,663.009,2.144362189,1.19E-08,0.227826795,Down,2.06E-07,-2.133990659,7.925152762,neg,0.990646413,2.777423414,1.267929816,6.753771318,6.820277117,0.797738806,3.187601229,0.598251689,0.789943021,1.564672683,3.312734877,3.95317425,0.545124085,3.659846211,0.701312787,0.983853505,0.921414843,1.000341609,4.609339096,3.486036996,0.883022846,3.979451907,2.92476386,3.821658196,1.027921515,0.659521724,2.173540227,6.994738971,0.698750526,1.808776844,0.680134493,3.631331799,7.200441077,1.221901932,4.066315669,3.970735059,1.247653302,0.580955256,1.078449015,0.924544224,1.305858257,1.031516458,0.513399847,1.35363532,0.918358279,4.384947858,0.645252995,2.130253659,423.4215223,423.4257565,Down,FA 28:0,S,423.4241,11.05,3386,[M-H]-,C28H56O2,FA,UTOPWMOLSKOLTQ-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCC,70.2,75,423.42401:212837 424.42736:44994 425.43072:0,50.80149:2157 52.83932:2300 53.17364:2498 53.20226:2102 59.01285:3752 76.22624:2341 85.49397:2809 104.45574:2596 177.39801:3004 210.41536:3326 263.81354:2896 423.42352:78249,423.4241,423.4241
M436T174,436.2864912,173.768,0.838989233,0.085573081,0.81049659,NS,0.152290675,-0.30312198,1.067662831,neg,2.166119513,3.089892971,2.855970886,1.315685015,1.260651599,1.741248354,2.998655262,1.268018049,1.462575123,1.883582067,3.137089778,1.845456002,2.651426172,3.390409008,2.460105173,0.684799782,2.962038726,1.665760975,2.66138304,1.314944012,1.228360654,2.826773587,2.681409975,4.274538715,2.621148001,2.448249154,2.733559612,0.473395587,2.069190497,4.125210116,1.162234581,4.683812168,1.519342621,2.204674379,2.663374035,3.265269643,2.053804304,1.788645069,4.097733905,2.013572557,2.357233576,2.290162806,1.218504584,2.185081514,2.470087938,2.810499064,1.80843117,3.882114111,436.2843098,436.2886727,Ns,LPE O-16:1,S,436.28674,2.887,3537,[M-H]-,C21H44NO6P,EtherLPE,RRTPYUGIBQLEDN-UHFFFAOYSA-N,O=P(O)(OCCN)OCC(O)COCCCCCCCCC=CCCCCCC,28.6,81.1,436.2869:426167 437.29025:131897 438.29361:21707,58.5429:2638 59.01268:24295 61.98726:11742 78.95806:85933 82.97563:2707 113.40535:2710 139.14784:2862 140.01128:46915 152.99582:5678 166.54387:2607 174.99344:4263 175.64488:2710 186.95667:6670 189.93126:6908 196.03867:46115 239.2392:37798 240.24297:7704 255.89456:2920 271.93558:5030 279.23422:5060 375.23187:4910 391.35883:6809 435.34885:6686 436.28543:24247,436.28674,436.28674
M445T145,445.3352658,145.239,0.453235446,0.318627513,0.865132241,NS,0.429896484,-0.20900742,0.496716726,neg,4.073380451,4.385541315,1.651525466,3.669824947,1.158421519,3.513486358,6.582480266,1.431614363,2.242824858,5.010158822,4.146864603,2.96256382,4.43563024,4.314251136,0.795518697,1.937381122,3.753769446,2.846265188,2.046773734,3.157675325,3.719884965,3.219554142,4.097036292,4.536761216,3.937535909,2.539497216,2.947034788,0.366168553,5.826856044,0.776321186,1.055855756,1.583910229,2.055309399,3.297306461,2.619584608,2.861555931,5.130289103,2.789960984,3.524538815,4.429502032,1.008556181,2.072604104,0.543988046,3.73488627,2.38670173,3.142446298,1.72091061,6.351438731,445.3330391,445.3374925,Ns,FAHFA 28:4;O|FAHFA 2:0/26:4;O,S,445.33578,2.43,3650,[M-H]-,C28H46O4,FAHFA,ZAALJMDGSMQOAB-UHFFFAOYSA-N,O=C(O)CCCCCCCC(OC(=O)C)CCCCC=CCC=CCC=CCC=CCC,26.5,52.1,445.33578:1126748 446.33913:294218 447.34249:224504,51.46405:2033 59.0127:58374 60.70192:2829 61.98727:6282 63.08227:2269 63.31296:2326 71.01271:2800 79.49171:2737 79.59241:2780 83.04926:7344 97.06518:3975 109.06473:3313 154.13924:2938 201.02623:5837 205.16035:5590 222.16466:3811 223.17154:3629 225.00827:4264 341.36542:3046 383.3356:7923 384.33893:4627 401.34534:33301 402.34976:7752 403.36032:10834 427.32651:13147 428.3299:4856 445.33569:47353,445.33578,445.33578
M452T136,452.2815607,136.448,0.549270704,0.981172253,1.002814651,NS,0.986953616,0.004054979,0.008254742,neg,2.159881985,2.12285989,3.381679745,2.071468423,1.545368001,1.830205592,3.267791562,1.29705614,1.207823433,1.864471606,3.011077795,1.514124018,4.512694823,2.555165109,2.218171949,1.285399086,3.094170768,1.534284145,2.092620933,1.889022438,1.399019638,2.794294885,2.583589316,5.06488466,3.191422782,2.267919851,1.689703292,0.675592065,2.91016948,3.605655085,1.336163175,3.73970982,1.415478612,1.896539279,2.62692806,2.148393464,1.669571632,1.589976719,4.14230896,2.790968256,2.195870333,2.470966905,2.033408239,1.485687847,2.673714591,1.474674571,3.710248338,2.55360395,452.2792993,452.2838221,Ns,LPE 16:0,D,452.28159,2.287,3756,[M-H]-,C21H44NO7P,LPE,YVYMBNSKXOXSKW-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,72.6,67.2,452.28159:367684 453.28494:82564 454.2883:0,58.13137:2851 59.01271:5660 61.98727:11939 67.4155:2844 72.54114:2597 78.95816:8049 87.31643:2831 112.63956:2758 121.9157:2782 134.80533:3289 146.9664:3659 159.53113:2933 196.03932:4522 202.22623:2791 255.23454:130184 256.23831:22907 328.26224:2869,452.28159,452.28159
M452T149,452.2815104,148.716,0.590240677,0.508916685,0.921434693,NS,0.613943396,-0.118046177,0.293353311,neg,2.022327678,2.215899497,3.100935118,1.997848124,1.541832065,1.781443892,3.753750154,1.284734493,1.193433702,2.126683916,3.232291215,1.657004699,4.306389318,2.535370863,2.417775327,1.175165006,3.172011842,1.822475559,2.072149109,1.957539289,1.348400227,3.392687105,2.798334215,5.740533684,3.008843492,2.336861842,1.925632051,0.710681234,2.545948163,3.722417297,1.497403935,3.918103813,1.56911895,1.837555847,2.763395171,2.350759787,1.732878605,1.428987212,4.036834581,2.769748605,2.259367239,2.292909388,2.31291474,1.43265001,2.609437632,1.664520898,3.610163818,2.734536761,452.279249,452.2837718,Ns,LPE 16:0,D,452.28186,2.471,3757,[M-H]-,C21H44NO7P,LPE,YVYMBNSKXOXSKW-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,77.8,81.5,452.28186:2419491 453.28521:708565 454.28857:120184,54.50593:2393 59.01265:5021 61.98706:5954 65.63657:2484 69.28334:2622 78.95804:69350 122.00021:6982 140.01138:44146 152.99553:11901 196.03845:70146 214.04924:11928 226.46057:3322 255.23442:664783 256.23792:117941 257.24069:5720 303.23557:5225 452.28287:5518,452.28186,452.28186
M464T277,464.3180939,276.753,0.840447092,0.090450252,0.806814905,NS,0.159155496,-0.309690359,1.043590221,neg,2.334879455,3.290457553,2.506157373,1.052201112,1.444960311,1.857496367,2.71855733,1.49897461,1.086087837,1.991641561,3.190278601,1.79255855,2.310556315,3.44659399,2.931897198,0.838390678,2.63252718,1.942449228,2.823694971,1.002505881,1.352739351,2.995945432,2.615105953,5.095595205,2.587006519,2.463156698,3.333573141,0.444750124,2.214636476,3.332574139,1.206366439,5.037331655,1.738177396,2.435338171,2.747834079,3.081858211,2.559438695,1.697271799,3.891090458,2.391994845,2.738916129,2.294709747,1.458865524,2.301528693,2.65622049,3.015918324,2.131802867,3.70712169,464.3157723,464.3204155,Ns,LPE O-18:1,S,464.31842,4.602,3933,[M-H]-,C23H48NO6P,EtherLPE,CDONWGCJDDHTLP-UHFFFAOYSA-N,O=P(O)(OCCN)OCC(O)COCCCCCCCCC=CCCCCCCCC,15.5,88.5,464.31842:549888 465.32177:187215 466.32513:41613,74.68723:2471 76.40474:2878 78.07836:2822 78.95803:97346 96.95921:20309 121.50182:3001 122.00063:5611 140.01132:54850 140.09459:3041 152.99536:6067 174.99263:58718 175.99582:3496 196.03854:59862 217.00383:445516 218.00714:42620 219.00818:9047 219.97833:90860 219.99985:4843 267.27118:51849 268.2746:8989 342.75238:3265 401.38425:3321 403.26599:8653 421.27292:2942 422.78967:3879 464.31763:54313,464.31842,464.31842
M465T289,465.3077106,288.708,0.996739291,0.023830022,0.734411528,NS,0.05567082,-0.445339391,1.622875557,neg,2.865322174,4.421451666,2.528895554,2.00632782,2.418402649,4.778165461,6.476248109,2.456519871,1.523625963,2.437628059,3.275566696,2.152895445,2.403426088,2.997821156,3.878800805,1.626963998,1.857224816,1.376190582,2.275768347,2.007912674,2.247171194,2.824276316,2.447901817,6.351922562,2.072612491,2.307230568,2.634911632,1.229534269,2.381407472,1.682371834,2.196261293,3.117401386,2.255612529,2.627479969,4.175609838,5.052347118,2.005377571,1.709113191,3.528792443,1.347198655,2.456337109,1.546592988,1.469901539,3.373221906,2.802075935,2.153431931,2.141768653,3.553873334,465.3053841,465.3100371,Ns,ST 27:1;O;S,S,465.30801,4.797,3943,[M-H]-,C27H46O4S,SSulfate,BHYOQNUELFTYRT-UHFFFAOYSA-N,O=S(=O)(O)OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2(C)CC1,65.6,68.5,465.30801:11579898 466.31136:4043269 467.31472:816750,59.01273:27245 61.98724:106248 66.26986:4453 70.43491:4848 79.95627:9729 80.04494:4931 87.30302:5116 87.41295:5057 96.95922:2184826 97.95854:16550 98.95494:28217 98.96343:6685 107.15144:4362 121.87777:5299 171.73584:4691 174.99196:12048 217.00378:30182 218.00726:18759 219.00691:4727 219.97862:75622 220.99869:6070 230.90117:5599 276.89603:4704 337.05713:5297 340.14249:4686 465.30753:841443,465.30801,465.30801
M476T117,476.2816685,116.798,0.838752842,0.061305002,0.747870137,NS,0.117192004,-0.419140317,1.212504088,neg,1.441603915,3.053110437,1.642664935,1.138557511,1.13721829,2.279823695,4.588531988,1.550025256,0.677014308,3.235807999,3.950397088,2.274930674,3.818140556,3.284770713,1.376716811,0.608106505,1.648544295,2.969768107,2.60624605,1.118577114,1.755822862,2.842919807,4.436672522,6.621780375,2.255944048,1.432182307,2.488844823,0.622138061,3.083730868,1.9088589,1.056975201,3.353020786,1.495818217,1.11338552,2.907842342,1.665747278,2.252432453,1.289725915,2.658365262,2.449028764,1.906460768,1.879984254,2.84912917,2.48083855,3.114745976,2.461405466,3.199132465,3.284758924,476.2792871,476.2840499,Ns,LPE 18:2,S,476.28201,1.943,4132,[M-H]-,C23H44NO7P,LPE,DBHKHNGBVGWQJE-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,74.7,82.8,476.28201:4824114 477.28536:1420978 478.28872:178252,50.94363:2958 56.4547:3778 56.56054:3180 59.01274:17094 59.80177:3216 61.98733:7725 69.99794:2995 78.95805:193024 81.34279:3287 115.92233:3951 122.00052:11754 140.0114:96477 142.09669:3641 152.99544:30394 162.73264:3884 175.2326:3719 194.84688:4552 196.03842:160155 197.04192:8551 214.04881:25929 237.84418:3528 279.23474:1143594 280.23816:255934 280.26978:8983 281.24176:11782 297.53723:3889 470.56854:4081 476.27948:10386,476.28201,476.28201
M478T158,478.2971677,158.236,0.909964189,0.050546078,0.737611799,NS,0.101075709,-0.439066361,1.296312537,neg,1.255870316,3.277967028,1.981926325,1.393565018,1.02022022,2.655734773,4.651637703,1.583589797,0.779873769,2.262633625,4.599026535,2.65623963,2.829037377,2.689945313,1.696500458,1.507198115,1.831360311,2.132424275,2.243452273,1.360778419,1.418225761,3.3116277,2.701333788,6.796599743,2.418478492,1.377676323,2.347386346,0.609346317,2.510274781,3.059350389,1.193835165,3.201963644,1.476417757,1.019907784,2.215812681,2.297892919,1.374141791,1.093401676,3.117782538,2.158562229,1.763873012,2.155693519,2.505452041,1.678004041,2.91909014,2.144403319,3.32342888,2.849323091,478.2947762,478.2995592,Ns,LPE 18:1,S,478.29749,2.634,4154,[M-H]-,C23H46NO7P,LPE,PYVRVRFVLRNJLY-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,76.8,73.7,478.29749:1900709 479.30084:502805 480.3042:0,52.69843:3444 59.01281:3720 60.90823:2679 61.98722:6371 68.63129:2862 78.3767:3184 78.95806:80120 79.09664:3206 83.18887:2738 105.12048:2997 112.75568:3657 117.54791:2771 122.00039:3224 140.01135:35402 146.3241:3030 152.99506:7475 196.03854:65569 214.0493:9366 214.29788:3205 255.23381:7282 281.2504:569603 282.25385:113843 283.25739:4675 419.88263:3098 472.82776:3302,478.29749,478.29749
M479T321,479.3235471,321.311,0.625238207,0.138522306,0.783080157,NS,0.223872349,-0.352768104,0.858480287,neg,2.759389605,3.850738032,6.193154944,2.665427981,7.785446287,2.319785483,5.20634574,2.033217381,2.498584289,2.46138445,4.852257954,2.632270341,3.286152325,2.337901051,4.809502125,1.720171122,3.663368041,1.672204446,1.935324075,2.539535062,3.755912853,3.256722156,2.532604622,8.608614752,1.866879528,2.844108785,0.988066506,1.446386276,1.712036617,1.805097642,3.911235573,4.18973326,2.052132695,2.111615216,4.63718406,5.60137105,2.744768843,2.057748471,4.133005033,1.353511156,2.900089741,3.342845499,2.627000693,3.261692905,1.950573224,1.779940363,1.973115498,2.03813264,479.3211504,479.3259437,Ns,ST 28:1;O;S,S,479.32376,5.341,4178,[M-H]-,C28H48O4S,SSulfate,NNLNVKVMYKIRMN-UHFFFAOYSA-N,O=S(=O)(O)OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(C)C(C)C)C2(C)CC1,65.8,82.4,479.32385:404334 480.3272:139231 481.33056:85594,55.44565:2450 59.01271:5873 61.98714:6489 64.56074:2377 88.98711:17719 89.02341:3241 96.95925:116187 98.95499:2624 101.97996:5921 109.72781:2641 112.17387:3804 125.17366:3143 187.61084:2733 283.26678:9963 284.2688:7138 305.82462:3182 323.25964:2917 397.33405:7324 409.31461:13451 456.6272:3435 479.32343:134778,479.32376,479.32376
M480T215,480.3127459,214.853,0.653171775,0.226033066,0.870500712,NS,0.329801491,-0.200082617,0.645828024,neg,1.808037636,2.296732977,2.978602395,2.268437591,1.618024407,1.823036739,2.825879373,1.030741637,1.010253454,2.119774064,3.327026219,1.489571987,3.746779254,2.52705237,2.745944346,1.186701337,2.547565857,1.543160163,2.414004127,2.328689111,1.63198439,3.709929437,2.612258926,5.679241585,2.82464788,2.354141824,2.178829824,0.810279451,1.946981195,3.251785725,1.631329088,3.247457387,1.951087687,1.868182891,2.800262642,2.104021532,1.949493433,1.570714624,3.854800806,2.66107953,2.591208939,2.316356978,2.123191767,1.879965762,2.716425441,1.573231866,2.781334644,3.51735352,480.3103444,480.3151475,Ns,LPE 18:0,D,480.31299,3.578,4186,[M-H]-,C23H48NO7P,LPE,BBYWOYAFBUOUFP-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,61.9,70.9,480.31299:430698 481.31634:89425 482.3197:0,54.50596:2224 59.01275:7428 60.90176:2802 61.98726:8703 71.03042:2488 72.44554:2581 78.95794:6773 104.71854:2533 147.30228:3555 147.67502:2811 154.06374:2840 154.85893:3044 196.03679:4687 214.04985:4796 217.00383:7172 257.53314:3667 283.2662:206094 284.26926:43861 352.24426:5969 409.31253:17484 453.19983:3894,480.31299,480.31299
M480T236,480.3132612,235.625,0.752728079,0.137997563,0.844758764,NS,0.223350365,-0.243388683,0.860128583,neg,2.028254783,2.502059981,2.99662713,2.356232686,1.888631734,2.110942611,3.578028475,1.399080323,1.247947256,2.495135367,3.173221908,1.587937024,3.418556099,2.490441025,3.189793243,1.363980553,2.764814196,1.998506261,2.548181939,2.244490555,1.536202386,3.996635103,2.833954389,6.394764964,2.733692881,2.671873544,2.528978007,0.884322664,2.194549195,3.473765038,1.687877325,3.871690735,2.187065599,1.967995718,3.090665355,2.482596297,2.152148504,1.567404257,3.965353603,2.784197953,2.908689293,2.34464352,2.2431317,1.903382653,2.770617563,2.082877995,2.668885439,3.580743287,480.3108596,480.3156627,Ns,LPE 18:0,D,480.3136,3.936,4189,[M-H]-,C23H48NO7P,LPE,BBYWOYAFBUOUFP-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,68.7,73.8,480.31354:2084272 481.31689:557406 482.32025:105118,51.74995:2457 59.01275:8799 61.9872:10108 65.26684:2364 78.95814:33877 87.3376:3871 89.1768:2706 92.33109:3040 121.49307:3158 140.01115:16888 152.99588:4304 161.87349:2909 174.99356:4082 185.83601:2864 186.68475:2986 192.92683:2893 196.03831:29667 214.04898:5092 217.00383:14759 226.46527:3112 283.2662:269372 284.26974:55680 369.66565:3493 409.31396:8944,480.3136,480.3136
M500T111,500.2821269,111.291,0.513500465,0.883868132,1.015454957,NS,0.919061348,0.022126247,0.053612524,neg,2.538274616,2.3181939,2.475560584,1.065086316,1.8186449,1.723292792,3.341254061,1.694859034,0.90356509,3.173024077,2.307819799,2.158718923,3.745968983,2.680598683,2.770784834,1.01564241,2.389154219,1.982341476,2.249334141,1.087417001,1.320089273,2.564242238,2.91634265,3.807388423,2.34930097,2.058593738,1.77305217,0.461808524,2.356505024,2.98613064,2.383467151,3.538145383,1.202922627,1.714509192,2.350738611,2.412604447,1.572418282,1.734347571,3.310805231,2.857408357,2.098278625,2.368514702,2.514009288,1.753727171,1.897502392,1.540870568,3.06102905,2.543445137,500.2796255,500.2846283,Ns,LPE 20:4,S,500.2825,1.853,4410,[M-H]-,C25H44NO7P,LPE,JPNPIRVRGLGTRE-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,61.9,74.9,500.2825:4295909 501.28585:1287142 502.28921:235055,52.86555:3066 53.88366:3350 54.03775:3645 59.01273:69272 61.98725:14545 71.01291:3651 75.43291:3639 78.95807:166812 83.04932:9164 91.43395:3656 118.31547:3901 122.00048:7805 127.48969:3441 127.52017:3998 140.01143:81245 140.0222:5016 152.99571:26378 175.31972:4412 181.62413:3832 185.47585:3940 196.03856:122484 197.04201:8942 205.19684:13489 206.19975:4764 214.04907:34627 241.53748:4309 259.245:41082 260.24805:6506 303.23514:300866 304.2388:75963 349.91348:5126 394.96228:4706,500.2825,500.2825
M502T132,502.2977991,131.573,0.456472625,0.688697274,0.941300644,NS,0.768800657,-0.087272513,0.161971636,neg,1.535613249,2.559607149,1.797565642,2.220393399,1.575662314,3.61678189,4.317609714,1.361911655,0.701022556,2.827570393,2.922316298,1.15431976,2.205787145,1.897383749,2.462139022,0.602386386,1.814463159,3.621315404,1.932063945,2.079966618,1.306191951,1.425222348,5.6697259,3.657932558,2.49889571,2.309959119,1.333211715,1.976616732,1.602521747,4.705446919,1.606947137,3.715323119,1.005958043,0.926136478,2.792005492,2.612978648,1.046802032,1.17878063,4.501108827,2.038436835,1.540770684,2.029915069,1.937695785,2.529888858,4.628296055,1.25450098,4.477716458,2.016082262,502.2952876,502.3003106,Ns,LPE 20:3,S,502.29816,2.197,4437,[M-H]-,C25H46NO7P,LPE,UEONHLLDVDPRRN-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCC=CCC=CCC=CCC,53.5,75.7,502.29816:260299 503.30151:63749 504.30487:9327,57.27431:2415 59.01277:7817 61.98731:6285 72.10578:2621 72.42455:2400 78.95811:13084 140.01198:5597 143.50536:2759 174.99265:10318 196.03827:14039 214.04639:3189 236.82352:3095 248.83536:2878 305.25098:67298 306.25333:15114 341.24927:15639 442.76636:3129 452.65546:4471 473.25635:2971,502.29816,502.29816
M524T104,524.2823828,103.776,0.291234301,0.939927466,0.991623222,NS,0.958729224,-0.012136038,0.02690566,neg,2.330081437,2.10492966,1.941850694,2.519919827,1.989485167,1.226711387,3.273359223,1.370038748,1.593195894,2.424463768,2.322451264,2.374541536,4.515625117,3.104652763,3.537427759,1.055613404,4.076857866,1.376026119,2.167702631,2.608248945,1.109809212,2.373104191,2.672972211,4.226395355,2.595979652,3.139174705,1.871394762,0.705601893,2.122807201,3.376952869,2.689857028,3.33872314,1.108165914,1.593603448,2.893745523,2.273997029,1.776176063,2.221047857,3.375005185,4.035070601,1.95736615,2.919858652,2.416644162,1.198019835,1.621132058,1.312456525,1.588903859,1.712406893,524.2797614,524.2850042,Ns,LPE 22:6,S,524.28259,1.722,4710,[M-H]-,C27H44NO7P,LPE,XEVRBOQZSXWGQO-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,17.8,64.2,524.28259:3320644 525.28594:1125082 526.2893:216542,78.95805:53063 83.0493:3795 101.15717:2701 107.08537:3431 109.21986:3675 116.87305:3220 119.94627:4863 127.5544:2996 135.11703:5022 140.01131:23847 141.01665:5455 152.99567:12798 156.76619:2811 192.95934:5415 194.95604:8631 195.93358:6265 196.03848:57074 214.04903:23072 217.00421:13932 219.97752:3828 224.07082:14908 227.20267:240398 229.19647:11948 239.64288:3093 242.08174:4111 283.24463:41509 284.24881:7790 327.23541:43653 328.23932:12753 378.52817:3528 452.28128:18589 454.7562:3622,524.28259,524.28259
M526T116,526.2983795,116.0395,0.849344372,0.062303834,1.292203746,NS,0.118630155,0.369833562,1.205485225,neg,2.355622616,1.5247013,2.605451161,1.259840299,1.676191297,2.637997883,3.496768011,1.901512015,1.020206904,3.225204902,1.952188583,1.333708047,3.258015457,2.350478639,1.78664465,1.225776723,3.09014573,2.782492998,1.444368803,1.229711453,1.287599283,1.64850076,5.033944689,2.657736708,3.593801836,2.515597783,1.173904539,0.40538416,2.572561105,3.597571942,1.887435748,2.595869884,0.727075954,1.458572908,2.181926886,1.73271429,1.246528735,1.410275571,3.677680802,2.264408949,1.983597804,3.254230361,2.575165753,1.568782708,2.316354734,0.979300785,3.908207123,1.635091651,526.2957481,526.301011,Ns,LPE 22:5,D,526.29865,1.936,4740,[M-H]-,C27H46NO7P,LPE,OSRWIBSZJTWIKA-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCC=CCC=CCC=CCC=CCC=CCC,43.3,73.8,526.29865:261604 527.302:104170 528.30536:0,50.90436:2524 59.01267:18322 59.35178:2864 61.29475:2872 61.98727:44362 78.95802:16281 85.78488:3020 108.87231:3366 116.97195:9567 140.0116:8688 141.01689:3234 143.99057:3737 196.03839:13112 214.05038:3783 218.58388:2838 227.20351:2942 241.21806:6543 278.22208:6151 326.01721:2930 329.25146:23951 330.25549:7793 375.6012:3468,526.29865,526.29865
M526T131,526.2980685,131.465,0.479353511,0.314661383,1.221969727,NS,0.425822954,0.289208544,0.502156553,neg,2.088682579,1.512620357,5.654228252,0.551025528,2.602974785,3.368688701,3.273992826,2.315402561,0.539038285,2.573030924,1.249443246,1.369964038,1.67093267,1.522232775,3.892248424,0.683984462,1.66668789,1.340381912,1.422669035,0.486359561,0.768256066,2.814908609,7.409328362,2.380942115,1.816195929,1.993994831,0.853530631,0.710031071,1.870440635,3.541626225,1.764316441,4.102060577,0.591150947,2.20236919,1.950275859,2.126207498,2.26202981,0.86607443,2.775845622,2.49671972,1.831165366,2.657633079,5.310652456,2.853378937,3.271001607,0.883736213,3.211040483,1.517686033,526.295437,526.3007,Ns,LPE 22:5,D,526.2984,2.189,4739,[M-H]-,C27H46NO7P,LPE,OSRWIBSZJTWIKA-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OCCN)CCCCCC=CCC=CCC=CCC=CCC=CCC,23.7,62.2,526.2984:226328 527.30175:74267 528.30511:0,54.92142:2479 59.01273:10210 61.98718:10062 78.95811:15199 96.63523:3069 116.12759:2928 116.97142:9880 140.01108:5423 156.81177:3496 169.59105:3001 173.62871:2821 174.99251:3214 196.03831:11470 198.77869:3361 217.00345:6062 219.98012:3728 231.21284:3403 246.28584:3149 285.26233:3830 329.25168:9138 330.25479:4228 450.44873:3861,526.2984,526.2984
M528T45,528.2678861,45.2583,0.40598078,0.364821384,1.228929171,NS,0.476765796,0.297401769,0.437919714,neg,1.553928224,1.694740181,1.472143731,0.767593193,1.923810127,4.95933027,10.34326034,1.472467199,2.937777905,3.4155174,2.28721017,1.912460529,2.685997437,6.053083917,3.45740814,1.726407548,0.267342113,1.913688311,1.666432457,0.9856684,1.569841295,1.533419115,1.243698132,1.896428002,3.522876156,2.236848442,0.911237326,1.970643264,5.193548895,0.519809558,8.624430142,1.502091993,2.534400824,3.591767642,0.708365159,4.478151706,2.782610615,4.056048559,2.494789761,5.509653027,2.293027051,3.369949224,0.422861912,2.184889653,6.385767388,2.899436907,4.246676536,2.015018918,528.2652448,528.2705275,Ns,BA 24:1;O4;G;S,S,528.26831,0.751,4763,[M-H]-,C26H43NO8S,BASulfate,QJZCNFGUZPMYAX-UHFFFAOYSA-N,C[C@H](CCC(=O)NCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OS(O)(=O)=O,18.3,75.1,528.26831:229990 529.27166:50366 530.27502:0,58.47908:2424 61.98726:12020 71.01256:3463 74.02373:32040 85.02866:3420 96.95912:24926 113.02347:5056 114.78258:2718 149.65674:3039 250.8775:2932 251.925:3088 292.74518:3963 312.80548:2886 448.30984:37681 449.31277:13371 470.95566:3967 528.26984:13502,528.26831,528.26831
M536T875,535.5501605,874.519,2.244673654,2.85E-10,0.190497341,Down,7.65E-09,-2.392157232,9.544459272,neg,1.05198775,2.971642115,0.906415116,6.851357843,6.130590663,0.934211669,4.336017664,1.17509294,0.735260673,1.161686489,3.009212473,3.467692712,1.169026436,4.939089895,0.71825315,0.307487921,0.466077474,0.555317865,6.5156354,5.905672936,0.718259505,4.177525811,4.947329965,5.811611747,1.107207951,1.115670302,3.626309105,6.472057267,1.03860259,1.153781663,1.13335311,1.962791239,5.388888593,0.385415349,2.781508279,6.297515289,1.18443231,0.978792396,1.149608972,0.925218873,0.939325296,1.367735515,0.348131602,1.023837199,0.221456838,3.513484136,0.971057643,4.418823934,535.5474827,535.5528382,Down,FA 36:0,S,535.55054,14.564,4862,[M-H]-,C36H72O2,FA,LRKATBAZQAWAGV-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,69.3,75,535.55054:625498 536.55389:233236 537.55725:55898,84.34614:2590 85.59876:3163 107.53976:3054 118.1429:3222 127.0005:35710 134.01826:4224 141.01649:52873 146.9662:4669 205.96126:3799 217.00349:5592 219.978:17424 222.95177:4183 337.05099:3159 510.86649:3327 534.53809:5144 535.54999:461292,535.55054,535.55054
M537T737,536.5076566,737.434,0.827207352,0.051257748,1.152894082,NS,0.102177435,0.205259976,1.290240482,neg,3.867911666,4.842097898,4.688091861,3.477426727,3.814390677,4.920800001,4.54813662,2.952987111,2.632785997,4.897324235,3.307995368,2.666607919,5.260439676,2.907478135,4.380949207,4.707038439,3.678240296,4.095304063,2.710325713,3.50121955,4.451466166,4.247615887,2.477111846,4.702934022,2.883768969,4.348969849,3.176533791,1.368563715,4.683199624,5.891130971,3.867843736,4.218474649,4.413276357,3.665669554,5.302498614,4.905694588,4.571756675,4.20509986,5.733705645,3.497406149,5.381988669,3.792861447,3.556992272,4.655769194,3.637120178,2.512455808,3.224831588,4.08854759,536.5049741,536.5103392,Ns,Cer 34:1;O2|Cer 18:1;O2/16:0,D,536.50763,12.283,4865,[M-H]-,C34H67NO3,Cer_NS,YDNKGFDKKRUKPY-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCC,45.3,66.2,536.50763:507735 537.51098:233162 538.51434:73302,57.03337:8246 59.01268:4671 61.98729:7470 66.31683:2972 69.03342:4364 76.4818:3029 80.02557:3611 93.31776:3129 171.68536:3455 215.13879:3223 235.2083:7254 237.22359:112320 238.2269:18468 253.25531:15035 254.24989:30475 255.23364:31619 255.25461:3903 256.23853:5054 263.23965:21059 264.24246:4300 266.25085:12284 268.26663:5567 280.26642:194036 281.26965:34443 296.26172:22508 297.26328:4587 298.23978:3406 308.29831:9549 452.4614:7053 453.46323:4194 488.48547:15960 489.49442:7618 504.48285:7297 505.48468:6690 506.49716:13715 507.50238:4987 536.50793:10160,536.50763,536.50763
M540T173,540.3713454,172.891,1.279131837,0.001774471,0.650148904,NS,0.006884607,-0.621157917,2.750931137,neg,2.95306871,4.872462086,3.289776517,2.020097098,1.434411871,2.10835293,2.715378685,1.344498331,1.528482567,1.825014694,3.440818282,1.877448654,3.323307333,4.041862209,1.911798758,0.557519909,1.9297719,1.922142932,2.94025726,1.946110278,1.480519218,3.289699571,3.360349956,4.52718537,2.677730874,1.964544475,3.461519401,0.677538966,2.831192018,3.553410849,1.21331205,6.144404047,2.57544081,2.172575375,3.911258068,4.508474014,2.268407598,1.725848591,3.654193448,1.752251485,2.160983449,1.891279759,1.285212308,2.164643528,2.204409302,2.835080357,1.916746565,4.911788402,540.3686436,540.3740473,Down,LPC O-16:0,D_POS,540.37164,2.874,4935,[M+CH3COO]-,C24H52NO6P,EtherLPC,RKKJZVVEVRCBJA-UHFFFAOYSA-N,O=P([O-])(OCC[N+](C)(C)C)OCC(OCCCCCCCCCCCCCCCC)CO,49.6,90.1,540.37164:1284215 541.37499:414216 542.37835:65705,59.0127:150469 60.01617:3306 61.98727:31843 68.87593:3359 78.95804:291687 96.28446:3196 96.96901:6986 115.58601:3773 129.97467:3128 143.99095:6977 152.99503:5973 168.04311:88645 169.04614:5389 174.99294:20356 203.89864:3294 217.00375:99040 218.00719:9753 218.33202:3311 219.97781:11453 224.06998:12734 239.23865:8405 240.24211:3271 242.65273:3468 279.23392:4797 301.22049:4084 315.25558:8582 349.65356:3312 374.99289:4248 377.24973:53379 378.25336:11070 395.26047:4691 459.2132:4939 464.31873:8833 465.32242:6853 466.33371:192068 467.33667:51640 521.42603:6845 539.4364:8618 540.44183:6573,540.37164,540.37164
M566T183,566.3875021,182.684,0.907488935,0.040902308,0.780410212,NS,0.085636594,-0.357695439,1.388252187,neg,2.969180199,4.050718399,3.415189409,1.790937015,1.318607512,2.428689787,2.526165607,1.341697021,1.573655133,1.871328873,3.650250744,1.571825944,3.830378768,3.634694093,2.785302857,0.944450096,2.029924408,1.983364242,2.372414206,1.779472099,1.776895308,3.416624127,3.104933589,5.337332713,2.731546124,2.022125789,3.3462199,0.772063214,2.912824787,3.987564781,1.501522225,5.177608757,2.908075284,1.737265682,3.750047602,3.479944421,2.388926054,1.83908357,4.620225165,2.565905351,2.469289769,2.565427572,1.649114022,1.927122798,2.01494265,2.71541458,2.33526955,3.90416419,566.3846702,566.3903341,Ns,LPC O-18:1,S,566.38794,3.039,5299,[M+CH3COO]-,C26H54NO6P,EtherLPC,LGYDTKYITBAFRQ-UHFFFAOYSA-N,O=P([O-])(OCC[N+](C)(C)C)OCC(OCCCCCCCCC=CCCCCCCCC)CO,44.7,91.8,566.38794:821357 567.39129:301419 568.39465:44350,78.95803:241136 141.01663:18879 146.96553:3985 152.99522:9270 164.49619:3071 168.04305:118238 169.04591:3694 224.07018:43007 227.6241:3402 238.91441:4232 242.08086:6495 269.25021:456820 403.26404:70757 404.26788:15511 421.2756:11421 492.34952:327418 493.35272:102169 494.32779:43567,566.38794,566.38794
M568T669,568.4988657,668.894,1.082412873,0.006078807,0.725109711,NS,0.018592396,-0.463728799,2.21618166,neg,2.864835906,4.521970528,2.726937892,2.725146675,3.879572992,2.340159643,4.140145853,1.583008619,1.25932048,2.55944102,2.969684949,2.472402276,2.657234624,2.038132252,1.983855215,2.140061307,3.268941922,1.611924504,2.410334013,2.761894367,1.582288972,3.352894623,2.081973216,4.826140585,1.778321501,4.988770378,2.819883249,1.235950438,2.30520126,3.922449125,2.25729423,3.943515263,3.346196927,1.924652125,5.803649627,4.202253948,2.099287538,2.452469722,2.50678157,1.648651367,2.114103726,1.440475927,1.324473313,2.555461635,2.665627647,1.65207459,2.152459932,2.564656135,568.4960232,568.5017082,Ns,Cer 32:1;O2|Cer 16:1;O2/16:0,S,568.49921,11.141,5325,[M+CH3COO]-,C32H63NO3,Cer_NS,PIVKMDKERPTVGC-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCC)CCCCCCCCCCCCCCC,62.5,84.4,568.49915:356397 569.5025:99892 570.50586:21168,53.12276:2424 59.0127:118740 117.38464:2856 209.19211:20874 226.21933:4171 235.20802:5058 237.22269:23761 238.22533:5644 252.23541:24442 253.23601:4652 254.2498:8859 255.23434:5423 280.26645:41113 281.2695:8811 296.26291:4217 314.03769:3145 460.45822:8402 476.45401:6375 478.46729:7508 508.47873:13179 509.47787:5808,568.49921,568.49921
M578T926,577.5976718,925.648,2.372331536,2.90E-13,0.130290408,Down,1.65E-11,-2.940197223,12.53770868,neg,0.945562166,4.55921065,0.734671229,6.331875302,5.528613003,0.808249324,5.233260851,0.454566964,0.655012218,0.179959845,5.645380533,5.1707021,0.933716867,5.736052597,0.638686036,0.88096319,0.702747044,0.29786167,5.770155388,6.697903703,0.833551216,5.091595811,2.282721056,5.267468831,1.046906669,0.875087238,4.285907744,6.284426743,0.928309875,0.436584461,0.787792716,3.673582509,6.768170496,1.109736446,4.977886793,7.122087289,0.644747687,0.399736942,0.431966044,0.50415802,0.417900358,0.697757832,0.522490538,0.907216348,0.451239229,3.335860365,0.885811241,5.01948981,577.5947839,577.6005598,Down,FA 39:0,S,577.59796,15.436,5428,[M-H]-,C39H78O2,FA,SDUXWTQRQALDFW-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,69.8,75,577.59796:563973 578.60131:290086 579.60467:55107,58.44477:2815 59.01275:21697 59.57534:2744 61.98722:9965 66.38297:2567 66.83489:2663 81.84306:3024 87.24324:2791 146.96509:4186 155.12149:3060 158.27657:2784 174.99286:4027 217.00325:5084 245.67075:3156 332.98605:4126 367.11652:3348 576.58502:4500 577.59741:217920,577.59796,577.59796
M595T676,594.5146562,676.169,0.359257117,0.933923916,1.007613009,NS,0.95448562,0.010941654,0.029688503,neg,3.38566242,3.826315297,2.744083936,2.432565545,2.432762563,3.042392097,2.853603689,2.230480627,1.568954155,2.780401978,2.158808147,1.286053692,2.713885468,2.215175156,3.09408987,2.156966304,3.191719353,2.681934464,1.969318477,2.348190814,2.132866826,2.679203308,2.032991099,4.194579586,1.707799658,2.971027789,2.825584973,0.732933672,3.038325692,2.896805746,1.971741558,2.704806673,2.574472439,2.489831794,4.83568153,3.131025424,2.423172878,2.620777248,2.932447736,2.616616697,2.810615783,2.355674216,2.243631915,2.885627276,2.048443779,1.35729494,2.035156314,2.286395519,594.5116837,594.5176288,Ns,Cer 34:2;O2|Cer 18:2;O2/16:0,S,594.51526,11.264,5630,[M+CH3COO]-,C34H65NO3,Cer_NS,GMWIWVUTMCBDSP-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCC,61.8,81.2,594.51526:1156110 595.51861:614762 596.52197:149209,50.08063:2369 57.13997:2782 57.20016:3169 59.01271:194269 75.34181:3340 75.75839:3535 84.64246:2639 92.17619:2991 109.99442:2882 138.63245:3359 172.55861:3169 174.10193:3928 181.86116:3074 226.34563:3012 235.2079:41679 236.21115:5358 237.22385:45050 238.22891:5093 253.25569:8907 254.25076:24598 255.2338:16150 256.24152:4331 261.22409:13834 262.22891:3768 264.2348:5422 280.26636:132715 281.21286:3871 281.26993:32403 293.1297:3517 296.26062:16809 297.26511:6554 319.86331:3295 486.47147:10530 502.46677:9401 503.46838:6122 504.48169:21569 505.48938:4424 534.49335:27475 535.49481:8415,594.51526,594.51526
M595T81,595.2941489,80.8149,1.209807541,0.002019388,0.642790802,NS,0.007643493,-0.63757881,2.694780228,neg,1.370604476,4.636591507,2.447743512,3.066170238,2.369441538,2.058651491,6.900665425,2.219067486,1.87270218,3.028760209,2.78498219,2.296773773,2.163904741,4.044078952,1.297556549,1.710796863,1.824846847,2.51612937,2.700810919,3.19760271,1.704426309,2.952146293,4.670794961,3.652714222,3.342037174,1.840465331,2.938878942,0.834810576,3.816603612,1.551305136,1.553926664,2.244242478,1.17709959,2.735276868,3.4727626,3.614728081,3.543943713,1.948915732,1.768972911,3.784826306,1.405706159,2.420725184,0.606972571,3.268348264,1.138832982,4.586553986,2.028325446,5.610002901,595.2911725,595.2971254,Down,LPI 18:2,S,595.29449,1.346,5638,[M-H]-,C27H49O12P,LPI,SAHCQBPGXQFTRA-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCC=CCC=CCCCCC,55.2,78.6,595.29449:301788 596.29784:102843 597.3012:27916,59.01281:4626 61.9872:12996 74.82402:2790 78.95806:38846 89.02352:9953 91.54141:3168 92.92713:7775 96.96864:7195 99.10634:3180 107.81005:3006 116.97226:6623 135.04439:5425 141.01671:4911 152.99567:76864 192.95863:8251 217.00298:4126 228.48564:3300 241.01317:39652 242.01575:3874 255.70389:3071 277.73413:4054 279.23462:77819 280.23773:19963 315.05151:12001 325.18646:6732 345.03177:3812 386.82251:3174 571.43494:3307 595.29449:11833,595.29449,595.29449
M597T737,596.5304564,737.439,0.895461843,0.027706263,1.172360686,NS,0.062831533,0.229416495,1.557422052,neg,4.102711052,4.928710075,4.580338784,3.308699948,3.894253508,4.980155112,4.356306156,3.023803855,2.620820381,5.10585052,3.270859261,2.579348953,5.096055732,2.918714715,4.467047242,4.698331251,3.593744737,4.065958806,2.873445141,3.426712813,4.945640639,4.182144959,2.671387151,4.690657936,2.984001197,4.494218053,3.175790309,1.46438855,4.766363172,5.878874051,4.069823592,4.217525936,4.538258406,3.590072296,5.348749554,4.830112405,4.645064508,4.217569403,5.893305138,3.601481808,5.509361142,3.751730846,3.546682723,4.811398123,3.622007728,2.570415772,3.214249414,3.790927212,596.5274738,596.5334391,Ns,Cer 34:1;O2|Cer 18:1;O2/16:0,D,596.53088,12.283,5657,[M+CH3COO]-,C34H67NO3,Cer_NS,YDNKGFDKKRUKPY-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCC,59.8,75.4,596.53094:5538926 597.53429:3314928 598.53765:694569,57.03355:5249 59.01271:174510 87.33541:3028 111.21719:2892 235.20775:3736 237.22362:56013 238.22705:6602 253.25487:4894 254.25096:21221 255.23376:10786 263.24094:14926 266.25095:6658 280.26636:97583 281.27014:20657 296.26239:12481 308.2977:7366 420.04529:3169 488.48819:9214 489.48965:3365 504.4859:5145 506.49704:11529 536.50964:14910 537.51392:7627,596.53088,596.53088
M619T78,619.2943493,78.0043,0.248707108,0.719525546,0.962616679,NS,0.793367173,-0.054966674,0.142953782,neg,2.141901916,4.380891725,3.03410173,2.56416464,2.479482902,1.723516171,4.53804485,2.103565929,2.332014142,3.315634469,2.399989442,1.959581268,2.724801606,3.86193036,2.224474931,2.78457607,2.510398635,2.929297465,2.081707867,2.646526804,2.407610964,2.836650446,3.243493994,3.307415091,3.410410349,2.672878632,2.265010382,0.604039801,4.118572581,1.99763548,2.395981637,1.602624419,1.245211912,3.622385816,2.91696846,3.166130562,3.824610344,1.913144138,2.613495697,4.856040504,1.885194967,3.491041751,0.765127973,3.235594626,1.056902287,2.719207879,2.262431937,4.352971986,619.2912528,619.2974458,Ns,LPI 20:4,S,619.29474,1.304,5942,[M-H]-,C29H49O12P,LPI,BAWAZBRKENFJED-UHFFFAOYSA-N,O=C(OCC(O)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCC=CCC=CCC=CCC=CCC,46,68.8,619.29474:648339 620.29809:260507 621.30145:41039,54.01877:2885 55.99213:3008 59.01274:19276 61.50429:2556 61.98743:10354 68.99438:5818 78.958:47336 92.9272:12296 94.92432:5293 96.96884:12362 98.06746:3306 112.98493:6728 115.37049:3125 116.97153:4504 119.94666:5940 141.01653:6528 152.99564:82267 185.50404:3180 192.95909:10866 217.00316:17266 241.01323:55643 242.14861:3334 259.0249:3458 259.24265:5762 303.23535:60430 304.23712:10009 305.4278:3445 311.17102:9779 312.17429:4276 315.05103:13839 391.72314:3453 619.29083:5848,619.29474,619.29474
M619T849,618.5861025,848.903,1.055141222,0.010553843,0.693325991,NS,0.028977096,-0.528394251,1.976589373,neg,2.404686207,4.682250749,2.40505523,2.068845187,2.427786916,0.860237517,4.017352158,1.561052842,0.647786137,1.74435024,2.949127193,1.303723935,3.697392225,3.498578815,2.793262814,3.057187936,1.406706729,2.308862421,1.993334452,3.163576192,2.164244124,2.910613865,2.774235487,5.449363248,2.75927372,2.800582106,2.587065514,0.293896565,2.265403954,2.18234599,1.102181221,3.803063001,1.94072942,3.156373833,5.217357936,3.91776594,2.095975024,1.191384589,1.942020487,1.425586381,2.318133368,2.137901433,1.474997491,3.507704396,1.990651112,1.37954568,2.156104025,4.979693938,618.5830096,618.5891955,Ns,Cer 40:2;O2|Cer 18:2;O2/22:0,D,618.58557,14.15,5930,[M-H]-,C40H77NO3,Cer_NS,AWTNSRHUZXWBCO-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC,53.5,69.8,618.58557:376371 619.58892:259844 620.59228:72356,50.42337:2470 52.2937:2828 57.03352:5479 59.01272:37081 75.83683:2938 110.59233:2743 235.20815:35378 236.21178:7115 261.22308:17948 264.2352:7483 304.0437:3199 321.31873:44580 322.32294:10573 337.34845:6940 338.34698:21536 339.33014:10749 340.3324:3835 364.36084:125378 365.31775:4510 365.36389:30043 380.35535:13069 487.97403:3219 570.56866:11795 586.565:7344 588.57581:9213 589.58008:3930 618.59021:5693,618.58557,618.58557
M620T969,619.6450471,969.167,2.406756174,4.36E-15,0.144659137,Down,4.44E-13,-2.789270648,14.3609317,neg,0.818201116,4.403513819,0.414362311,6.286009863,3.624926638,0.779268545,4.239765773,0.854428266,0.281783758,0.755273764,5.054164943,4.764607517,0.929704458,4.018939276,0.245229129,0.813888539,0.665338684,0.693490362,5.408232906,4.037765272,0.540590798,3.964335261,4.458780368,4.243300113,0.936136004,0.825169491,3.532380844,3.855634007,0.833804925,0.399569867,0.697561031,5.733832893,6.230468634,0.913536864,4.719818356,5.21811395,0.741306493,0.453236511,0.843817561,0.345757987,0.889005539,0.434722846,0.70013546,0.485165609,0.587473118,3.474511664,0.895381105,5.42831738,619.6419489,619.6481454,Down,FA 42:0,S,619.64563,16.166,5947,[M-H]-,C42H84O2,FA,GIGASBXFYYRSBK-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,54.1,75,619.64563:612391 620.64898:287111 621.65234:73451,87.2832:3432 112.97366:3855 127.00045:32873 141.01656:47465 142.01999:4328 146.96535:5975 155.04504:3596 160.94475:3410 174.9928:26004 217.00391:247031 219.97934:8873 221.15601:7364 225.57477:3988 235.37848:3297 235.81691:3383 284.3309:3712 340.70407:3395 346.99072:3974 374.99448:60274 529.46326:4258 559.44354:7340 617.62872:9961 618.62921:19230 619.64453:493199,619.64563,619.64563
M623T743,622.5461815,742.57,0.103633102,0.826819428,0.976985345,NS,0.876045617,-0.033591174,0.082589327,neg,2.805862855,4.114918336,3.240235411,3.740134176,2.842377771,2.031767545,2.677551498,1.805643178,1.715366178,4.250198714,2.786352466,1.883127733,1.76165951,2.237404521,4.005855984,3.791669207,3.521429048,3.905713671,2.172654213,3.612582292,2.887361164,3.33240711,1.580195715,4.613745108,1.907345105,4.018506291,1.998847084,0.888009311,3.17266632,3.042634753,2.846852388,2.618563019,3.96417729,2.71247161,5.571175979,3.108680501,3.195305401,2.656402652,3.650153123,2.425705072,2.795794031,2.743393948,2.445177453,2.084733019,1.84239609,1.154045906,1.616184822,2.772056975,622.5430688,622.5492943,Ns,Cer 36:2;O2|Cer 18:2;O2/18:0,S,622.54681,12.371,5980,[M+CH3COO]-,C36H69NO3,Cer_NS,WNPWDGNHTKGEDS-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCC,55.8,76.4,622.54681:719902 623.55016:380133 624.55352:116899,59.0127:381108 60.01608:9090 62.40503:2612 68.31271:3364 87.2745:4256 93.06709:3336 115.79369:2978 119.18834:3041 127.70155:3085 146.66211:2850 172.90677:3357 235.20772:28290 236.21167:6109 261.22333:17970 263.23849:3539 264.23456:9025 265.2554:43256 266.25479:7290 281.28568:5245 282.28238:17306 283.26382:8374 284.26776:4223 306.2811:10392 308.29797:120293 309.30121:24698 324.29361:10746 404.60754:3764 514.50366:10145 529.46631:8848 530.4942:6285 532.51434:10902 533.52423:4454 562.5191:16982 563.53101:10201,622.54681,622.54681
M625T796,624.562045,796.256,0.699160775,0.044524481,1.233010652,NS,0.091414016,0.302185263,1.351401132,neg,3.690533263,6.24647059,6.639129655,7.086373692,5.066925103,4.315292439,5.972043689,2.735176783,3.842982183,9.904692434,5.475754593,4.315053924,7.186321356,3.061497943,7.046155158,9.394703195,4.320996889,5.51759283,3.67105568,6.64205954,7.060463795,5.339437057,2.422726996,6.31298197,3.534024381,7.835115002,2.933608508,1.909136033,5.4663548,7.903875696,8.569346686,4.200127708,7.325506014,4.593832518,6.225452596,6.058065043,10.14460823,6.23811609,7.557013906,4.05989166,8.176505971,6.879348604,5.307440367,3.514827399,3.709615456,2.575161323,3.64484039,4.940274059,624.5589222,624.5651678,Ns,Cer 36:1;O2|Cer 18:1;O2/18:0,S,624.56268,13.273,6006,[M+CH3COO]-,C36H71NO3,Cer_NS,VODZWWMEJITOND-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC,54.3,85.5,624.56268:1547812 625.56603:699295 626.56939:125855,50.82298:2792 51.66788:2505 53.7481:2753 57.03347:6249 59.0127:341621 60.01614:9617 61.98729:5099 69.03353:5174 87.32335:4294 91.86317:4410 91.86777:5204 106.12867:3274 106.79774:3032 126.24802:3230 164.34953:3954 184.50043:3313 203.18959:4079 209.19191:22033 235.20798:12821 237.22359:45313 238.22578:9558 250.25502:4497 263.23944:28756 264.24368:4817 265.2554:64363 266.25333:15525 273.96564:3461 281.28659:6436 282.28201:30048 283.26465:21965 293.28574:17814 294.29041:3601 308.29813:153786 309.24695:7586 309.30081:38454 310.31247:8155 311.29834:7009 324.29205:23455 325.29636:4238 326.27271:4860 336.32944:47644 337.3327:10412 352.32489:4545 400.6839:4536 516.51862:20323 517.52448:9069 532.51276:19730 533.5152:6436 534.53058:25728 535.53217:8761 564.54095:44334 565.5434:14968,624.56268,624.56268
M645T845,644.6014599,845.0865,0.36770538,0.46113699,1.094078124,NS,0.570105458,0.129715759,0.336170039,neg,2.699681751,5.044968388,3.352219208,3.262542,2.081084268,1.495351646,2.411939249,1.41963473,1.165286133,2.665791133,2.349933862,1.301282234,3.591642575,1.746072425,3.751524996,4.089038704,1.912552366,2.953143177,1.399885547,3.203030578,2.808346214,2.018278601,1.162508048,3.111328429,2.085313495,3.875991409,1.699006888,0.610045204,3.591342133,4.058894986,2.100872063,3.074212697,2.62952607,2.523873707,5.070325356,2.856768498,2.19596683,2.266858241,4.136698442,2.26227207,2.423622985,2.997682757,2.616283764,2.342682256,1.978531761,1.078191668,2.093039586,3.150464102,644.5982369,644.6046829,Ns,Cer 42:3;O2|Cer 18:2;O2/24:1,D,644.60187,14.088,6262,[M-H]-,C42H79NO3,Cer_NS,RWMLFFULUMHLPQ-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,43.1,61.3,644.60187:681369 645.60522:407967 646.60858:80751,57.03314:3809 59.0127:7235 60.18807:2569 62.84045:2852 69.03358:3372 73.18075:2860 75.96812:2790 79.69958:2833 82.8287:2692 87.40937:4470 91.86548:7511 92.16706:3580 232.50693:3706 235.20766:45373 236.21191:10466 237.22348:8803 261.22394:16876 262.22675:4350 264.2099:3381 264.23532:12678 266.25134:3415 295.18497:3668 347.33481:29052 348.33896:8576 359.27588:3236 364.3609:18882 365.34753:10421 366.35049:5401 379.20712:3692 388.36264:10528 390.37692:141368 391.38101:40477 406.3718:14802 407.37457:5782 454.39313:3371 495.69931:3375 538.17719:3326 596.58496:12556 597.58423:5056 614.59344:7231 627.51868:3655 644.60144:5363,644.60187,644.60187
M647T887,646.6166624,887.315,0.935126938,0.005929732,1.351141355,NS,0.018251499,0.434178616,2.226964901,neg,3.250378358,6.220204398,5.794714862,5.940972945,3.506887468,3.421784487,3.847315792,4.379703354,3.51802971,7.070638438,4.187746173,4.351732548,9.259947574,6.062106721,6.897571823,10.48066874,3.283434039,5.028838586,3.004315122,7.958012691,5.763342882,3.228264631,4.811354888,3.372480336,3.369378813,10.12510292,2.506427984,1.616114098,6.216417836,8.377357776,5.390011892,3.650607015,4.627421736,3.85196385,4.522564982,4.228188891,5.832431883,5.473084265,8.321582082,4.897370168,6.183208357,7.071441565,5.90448892,3.608396352,3.745540115,2.430165884,4.574975294,5.088875079,646.6134293,646.6198955,Ns,Cer 42:2;O2|Cer 18:1;O2/24:1,D,646.617,14.774,6288,[M-H]-,C42H81NO3,Cer_NS,VJSBNBBOSZJDKB-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,42.7,62.5,646.61719:722578 647.62054:468288 648.6239:88493,50.97409:2363 59.0127:3800 61.98727:13607 64.35795:2789 69.03377:3498 79.98694:3298 80.02596:3824 91.86279:6744 93.243:2954 98.94481:3061 104.46347:2973 128.90674:3255 143.81898:3085 215.97075:3117 217.00351:6375 219.97815:10856 237.19983:3196 237.22351:62771 238.22694:7675 263.24008:25971 264.24429:6342 266.25034:12710 316.95236:12157 347.33383:48406 348.33911:9754 363.36838:4274 364.35986:26391 365.3432:19858 366.34705:5463 390.3768:187712 391.33029:6028 391.3801:58231 406.36984:19034 407.37558:3860 471.89505:3401 598.59796:10500 599.60242:6618 614.59644:4323 616.6059:9079 617.6098:7101 646.62012:4684,646.617,646.617
M648T1003,647.6766984,1002.66,2.407324164,1.26E-14,0.108578057,Down,1.10E-12,-3.203195517,13.89961879,neg,0.633563549,5.511736027,0.817419861,6.732625281,6.078723828,0.725501556,5.271477461,1.022349885,0.69874935,0.44273137,4.860805019,5.471942708,0.597117741,5.708462823,0.632765097,0.381678978,0.801430601,0.382915482,3.527725995,6.555331564,0.820186747,5.295422949,4.269360339,5.507365443,1.041427954,0.473974834,4.722372919,6.358689782,0.509915991,0.375869027,0.686353713,7.243950087,7.435809207,0.18280852,5.130788939,6.594632645,0.393957365,0.855067561,0.946308793,0.833649518,0.433010235,0.477716418,0.481934894,0.457868741,0.393496827,5.730818632,0.414755739,3.264943134,647.67346,647.6799368,Down,FA 44:0,S,647.67719,16.721,6297,[M-H]-,C44H88O2,FA,ZMVSDJGYGGPPIZ-UHFFFAOYSA-N,O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,65.3,75,647.67719:307674 648.68054:118237 649.6839:35556,50.16353:2535 50.58372:2733 51.88161:2674 56.91236:2614 58.74852:2273 58.82476:3158 59.01266:12305 60.57369:2751 61.98721:7435 73.31255:2614 76.11656:3259 141.0164:17956 142.98517:3118 157.01196:3604 217.00397:11704 242.49149:3432 271.70551:3380 274.86752:3400 390.72055:3211 647.67578:103669,647.67719,647.67719
M649T930,648.6325649,930.408,0.983384459,0.003808488,0.763281853,NS,0.012819882,-0.389712203,2.419247378,neg,13.13576215,7.427137321,8.590780021,15.30413757,15.99150264,7.947308214,15.56603639,12.22313719,5.570161149,9.585572505,14.54871268,18.57725016,17.45511324,14.5459566,7.085656549,9.69691424,5.364980674,8.199844214,21.45000439,15.70377709,16.65761907,16.18764814,17.42609646,16.87477865,14.41626855,10.69162423,7.66803259,14.46133266,10.73012056,15.15978748,9.060138371,13.80501521,19.03630578,26.25817871,10.08835574,16.33669933,11.9378292,8.548365626,9.129979798,6.502795446,17.27416547,10.51901768,8.386290098,18.511278,11.01400234,16.7995926,16.74642176,17.648721,648.6293217,648.635808,Ns,Cer 42:1;O2|Cer 18:1;O2/24:0,D,648.63348,15.499,6305,[M-H]-,C42H83NO3,Cer_NS,ZJVVOYPTFQEGPH-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC,60.8,46.8,648.63348:251082 649.63683:121627 650.64019:22499,57.03344:4994 57.61048:2576 59.01271:19512 61.98723:17556 66.75715:3290 69.03351:4529 87.1752:3239 106.38863:3524 141.01648:23106 167.07431:4467 217.00424:8047 219.97885:3864 237.22301:31659 238.22656:4538 239.24002:5332 263.23932:16144 266.25327:4533 303.91879:3250 349.35031:35414 350.35294:9871 366.37747:11595 367.36243:7930 392.39243:93892 393.39426:24336 408.38733:6994 600.61957:6462 601.62506:3748 618.62335:5586,648.63348,648.63348
M650T508,650.4824813,507.674,0.464289074,0.556042433,1.084270541,NS,0.655273527,0.116724775,0.254892065,neg,2.963827268,3.525381231,2.334333068,3.268062512,1.142729867,1.602753459,1.470031183,1.445621966,1.922176829,2.065765639,2.673566001,1.440691272,3.925735134,2.698089135,3.38669788,1.40833388,1.844491716,1.775303416,1.475939101,3.236246314,2.179275764,2.349705594,1.810817802,2.954903379,2.335692085,3.428164089,2.800851755,0.513451182,4.289627793,4.807859585,1.336016944,5.456707685,2.624469979,2.337056187,3.587774509,2.589482858,2.030916089,2.577055453,7.593191899,2.810012527,2.557822247,2.353924956,1.989704454,2.26782907,1.620403469,1.621103056,3.351109912,1.865230042,650.4792288,650.4857337,Ns,LPC O-24:1,S,650.48279,8.456,6326,[M+CH3COO]-,C32H66NO6P,EtherLPC,RBLLXUQXTBAKQS-UHFFFAOYSA-N,O=P([O-])(OCC[N+](C)(C)C)OCC(OCCCCCCCCCCCCC=CCCCCCCCCCC)CO,54.9,92.3,650.48279:290342 651.48614:135343 652.4895:29064,132.98132:16081 140.743:3560 141.01633:14077 143.99091:5494 146.54593:3061 146.96616:3372 168.04314:61682 240.9653:58436 241.96919:4539 322.96951:46230 404.9747:3950 487.35928:40092 488.36349:16287 514.43353:3846 576.44391:185923 577.44818:74413 578.45605:4032,650.48279,650.48279
M651T800,650.5780122,799.6555,0.658709201,0.146072351,0.840522762,NS,0.233515646,-0.250641205,0.83543198,neg,2.058096284,4.407028862,2.514463947,3.053293473,2.351364515,1.590600188,3.710639034,1.511802126,1.156507632,2.82120353,2.646056285,1.433509693,2.813052277,2.590153907,3.972543668,2.87296159,2.202653729,3.015226791,2.10307366,3.107697407,2.490013541,2.757230687,1.557389197,5.053591271,2.056480653,3.031673917,2.186496818,0.711564716,2.983798486,2.922096819,1.923391093,3.161629183,2.442322051,2.075970994,5.567941305,2.74403669,1.903541871,1.667990407,3.829648339,1.766256487,2.542492016,2.318936209,1.873294805,2.36520552,1.976617334,1.271558309,2.176999799,3.599376829,650.5747593,650.5812651,Ns,Cer 38:2;O2|Cer 18:2;O2/20:0,S,650.57855,13.327,6327,[M+CH3COO]-,C38H73NO3,Cer_NS,NBSDZPNNDCXPFZ-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCC,49.2,77.1,650.57843:782018 651.58178:372746 652.58514:79456,53.06922:3095 55.55354:2545 57.03348:5175 58.50454:2578 59.01271:285951 60.01588:4954 63.18718:2632 63.45273:2818 63.78586:2825 65.20895:2687 67.68691:3329 81.98781:2664 87.38264:3142 89.54314:3132 147.04773:10889 166.30788:3412 171.75958:3877 199.11652:119436 200.11847:13692 219.17819:3823 235.20775:39264 236.21111:6178 240.39145:3788 245.90878:3075 261.2226:20111 264.23541:9408 265.23975:4382 281.17856:3636 293.28723:48640 294.29099:10229 297.15079:6212 309.31885:5759 310.31412:27679 311.298:14809 334.31564:5125 336.32977:142164 337.27756:5373 337.33224:30595 352.32474:13428 435.55603:3868 541.35217:3607 542.53613:13253 543.54132:5753 558.52802:11129 560.5451:14699 561.54773:6369 590.55792:19149 591.56451:6890,650.57855,650.57855
M652T605,652.498075,605.225,0.525404826,0.453202243,0.932064329,NS,0.562490078,-0.101498565,0.343707949,neg,3.363018781,3.648840218,1.879944349,3.280365914,2.281786395,2.132584225,2.4908921,2.037619544,1.848948586,2.408066388,2.366731492,1.907848337,3.665532419,3.106081464,2.594660232,1.320983753,2.701150848,1.91444499,1.832597102,3.131287273,2.332277353,2.900835962,3.228892881,3.460967764,2.201983005,2.865890426,3.229518904,0.627831126,4.09904817,4.231492519,1.390699512,4.840555885,2.313363502,2.635360556,3.588520495,3.302679573,2.760482115,2.635914998,4.150271618,2.671674766,3.258718624,1.773430511,1.732687968,2.808111509,2.318589814,1.890371358,3.019436115,2.324172677,652.4948125,652.5013375,Ns,LPC O-24:0,S,652.49847,10.09,6350,[M+CH3COO]-,C32H68NO6P,EtherLPC,YWBUJPLAZHBWTG-UHFFFAOYSA-N,O=P([O-])(OCC[N+](C)(C)C)OCC(OCCCCCCCCCCCCCCCCCCCCCCCC)CO,56.6,91.1,652.49835:242923 653.5017:113556 654.50506:16569,52.43489:2414 58.11922:2654 59.0127:45399 61.98721:7701 71.12475:3616 78.95802:130122 87.33598:2912 132.98132:6924 143.99046:5170 168.043:39012 240.96542:13648 283.91782:3507 288.45435:3026 291.89221:3305 307.07086:3431 322.97018:7279 395.70462:3325 423.6503:3844 489.37689:19818 490.37515:6888 578.46027:85777 579.46448:30715 580.46759:4523 640.2403:3534,652.49847,652.49847
M653T846,652.5938502,846.4175,0.453432946,0.300446373,0.91224277,NS,0.410746684,-0.132510283,0.522233035,neg,4.775008339,6.731501317,6.0701473,8.216198894,7.46795138,5.064510731,11.67083905,3.66272429,3.138528262,8.347188318,8.24979251,6.264665688,9.114350469,6.142265907,6.502563987,9.732703161,4.080393649,4.414223089,6.160404049,8.961392747,8.295362573,7.756259534,4.899273811,9.585087076,5.718255843,10.43040159,4.619761487,3.171471233,6.634867067,9.565093891,7.742397314,6.176264067,7.194441602,6.674220482,9.187033121,9.281922647,6.710958744,5.456793104,9.844814236,4.356473081,9.242565553,6.072474821,5.28622359,6.868679413,5.348078018,4.440855355,6.652476658,9.305882149,652.5905872,652.5971132,Ns,Cer 38:1;O2|Cer 18:1;O2/20:0,S,652.59448,14.109,6351,[M+CH3COO]-,C38H75NO3,Cer_NS,XWBWIAOWSABHFI-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCC,41,87.9,652.59442:1414413 653.59777:660600 654.60113:125164,51.4248:2757 51.92611:3205 54.3405:2995 57.48381:2954 59.0127:237580 60.01592:4835 66.61402:2985 69.58201:3098 82.97058:3383 87.26077:3376 199.11717:5312 209.19154:19701 232.25804:3337 235.20772:13261 237.22292:19391 243.94028:3346 263.23889:8866 264.24161:3557 293.28656:17294 310.31351:11237 321.31955:21173 322.32172:4216 324.93646:3707 336.32941:56721 337.33279:14208 338.34552:16065 339.32632:4840 352.32358:9456 364.36084:70829 365.36356:16021 380.35431:5715 456.04788:3902 534.74847:3647 544.55304:11275 545.55121:6620 560.54364:10267 561.54547:3591 562.56085:13533 592.57288:20185 593.57294:14322 600.53168:3277,652.59448,652.59448
M665T849,664.5944625,848.72,1.141620061,0.003885391,0.689010885,NS,0.013022131,-0.537401321,2.41056532,neg,2.256002874,4.4044126,2.678009898,2.09110154,2.829323102,1.465433527,5.125382018,1.168612804,0.738885998,2.514366662,3.643443981,2.062098791,3.687197193,3.717849291,3.112447378,2.897958392,2.448742366,2.50362198,2.496501815,3.532441559,2.491281707,3.823797107,2.555343428,4.933790936,2.451034137,4.288096555,2.819095544,0.539376264,2.002751023,2.162624428,1.180513001,4.082641561,2.60835803,3.507733565,4.975747679,3.837167849,1.460741191,1.17344357,3.152142376,1.399258275,1.808541046,1.313906076,1.913464546,3.985755224,2.125163111,1.35244769,2.081651316,4.885633657,664.5911395,664.5977855,Ns,Cer 40:2;O2|Cer 18:2;O2/22:0,D,664.59485,14.15,6489,[M+HCOO]-,C40H77NO3,Cer_NS,AWTNSRHUZXWBCO-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC,61.2,34.8,664.59479:426308 665.59814:175406 666.6015:65248,51.85269:2366 56.12808:2661 59.01276:5468 74.45368:3328 80.50525:2938 92.95355:2915 103.21478:3015 111.2981:3324 115.4541:3466 203.69792:3493 235.20822:10454 261.22305:5833 272.63528:3748 304.41922:3782 321.31912:8282 364.36087:26612 365.3652:8853 380.35107:4135 394.59695:3568 570.56549:3885 643.90234:3720,664.59485,664.59485
M667T870,666.6099618,869.522,1.602960282,3.54E-06,0.609179631,NS,3.62E-05,-0.71506039,5.450709773,neg,6.066864732,6.805424563,5.389677051,7.516177738,11.74080613,3.716580973,10.02803397,2.998379665,2.505131324,5.472532781,8.907498828,11.08245585,6.893062986,8.36095287,4.566711174,5.954010603,4.552482318,4.038089858,6.72011969,8.215635812,8.451753625,11.65586851,5.955142735,11.64026096,5.450378745,9.968028524,5.375625959,5.720801586,4.243954504,7.675836075,4.098987472,8.850707181,9.135469774,8.370218309,9.298880095,10.56463568,5.005836998,4.420124411,4.643964651,2.423601919,5.520513255,4.293081513,2.82011548,7.030162813,4.94271026,4.744534296,6.849454935,11.64120556,666.6066288,666.6132949,Down,Cer 39:1;O2|Cer 16:1;O2/23:0,S,666.6106,14.494,6515,[M+CH3COO]-,C39H77NO3,Cer_NS,WYSRACVJQVNCRW-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCC,49.5,80.6,666.6106:343407 667.61395:176954 668.61731:57149,52.49291:2799 57.95897:2853 59.0127:112996 60.01625:2888 61.98727:8518 64.78162:3385 69.90562:3531 76.81044:2746 86.99255:2585 91.86473:10246 93.66068:2901 102.4959:3735 112.15533:4682 122.11009:3047 160.24643:3245 165.77643:3079 174.99228:4823 191.38625:3566 195.37659:4316 208.57808:3993 209.19214:17009 223.20772:7175 235.2072:10108 238.22171:4890 249.22217:5701 311.54584:3805 321.31799:5644 335.33386:12581 350.34637:11232 351.35245:3288 352.36166:4465 364.36133:26840 378.37711:44282 379.37988:11753 380.35812:3800 558.56555:7801 574.56494:8744 576.57318:8103 606.58856:13016 607.58856:3916 641.19354:3730,666.6106,666.6106
M679T848,678.6098455,848.4755,1.237609404,0.00170135,0.638437717,NS,0.006654178,-0.64738221,2.769206244,neg,2.495483598,5.534162538,2.498387376,2.007083364,2.374767622,0.86844597,4.091305884,1.042870928,0.71925679,1.571993852,3.558525267,1.376048896,3.551075154,3.57186157,3.008617744,0.980881611,1.710973821,2.444536498,2.477580595,3.484449268,2.48866203,3.719394756,2.513611788,4.746281826,2.407307085,2.928209311,2.730643763,0.582400403,2.010198945,3.060503196,1.104921333,4.066451381,2.479545826,3.303686146,4.96619845,3.806897189,1.920397137,0.926679891,1.73780627,1.255385788,1.773714035,1.972287333,1.867898737,3.682930022,2.098360658,1.309666291,1.89282838,4.737693076,678.6064524,678.6132385,Down,Cer 40:2;O2|Cer 16:1;O2/24:1,S,678.61035,14.15,6642,[M+CH3COO]-,C40H77NO3,Cer_NS,ODRVSCJZSDNQBP-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,51.6,80.6,678.61035:5568842 679.6137:3682457 680.61706:836021,59.0127:811631 60.01606:11863 65.51781:3095 69.03366:4740 70.36314:3543 71.01219:3088 74.5501:3566 87.34451:3982 91.86732:7543 140.22079:3241 157.9725:4610 176.04103:3310 207.17696:7310 209.19191:76064 210.19604:12798 213.3214:3712 222.22284:4579 231.71475:3220 235.20746:40850 237.22371:20775 238.21979:13530 240.23367:5596 263.24002:7167 263.72372:3779 319.30295:9253 336.33026:8280 337.31549:4722 347.33469:48948 348.33954:12257 362.34534:55519 363.35324:10969 364.36035:37041 365.3418:24890 366.34811:7703 378.34042:7102 390.37689:223670 391.32898:6947 391.38007:69147 406.37073:25534 407.37445:6958 570.5661:25148 571.57428:15753 586.56189:18481 587.56494:8418 588.57288:26173 589.58527:11474 618.58759:41377 619.59521:20834,678.61035,678.61035
M681T891,680.6256279,891.318,0.815825082,0.017519466,0.820647704,NS,0.043310055,-0.285165075,1.756479138,neg,9.875100946,7.967531156,8.454535825,13.33319758,14.13574008,8.433855614,17.50664642,8.880165565,4.865027471,10.39445869,14.40131999,12.81340236,17.26585275,12.95584836,8.497040952,10.29069871,5.184661906,7.876850617,15.55867164,13.45933916,16.62704798,14.70191516,13.18195623,15.16514115,11.00477282,12.361024,8.202208344,9.280143038,9.006498878,14.15449681,9.052115664,11.54508172,17.06960292,20.83514191,10.76385847,16.55078245,11.98974938,7.554877558,11.04623415,6.213503465,16.93528688,10.85553221,7.667180572,16.96875433,10.56571786,12.34774037,14.45798827,16.54386408,680.6222248,680.629031,Ns,Cer 40:1;O2|Cer 16:1;O2/24:0,S,680.62616,14.851,6670,[M+CH3COO]-,C40H79NO3,Cer_NS,UVOIUTYXLKCPEC-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC,29.7,89.6,680.62616:2745440 681.62951:1503222 682.63287:419554,51.32355:2606 53.22257:2649 57.03349:8670 57.97448:4497 59.01272:467418 60.01612:9845 61.98721:8815 64.75664:2814 67.70446:3468 69.03369:4179 76.46632:3373 92.99534:3632 101.83024:3655 148.14998:3562 202.98763:7927 209.19232:22886 217.00418:7763 235.20825:15723 237.22382:61574 238.22594:10197 263.23975:33051 264.24438:4164 266.25058:12669 321.31827:68999 322.32129:16474 335.33496:4738 337.35059:13246 338.34497:39313 339.32593:27299 340.33286:3935 349.34985:20083 350.35355:4221 352.36264:5774 364.36084:223416 365.31824:6374 365.36417:56807 366.37662:10566 367.36221:6509 378.38013:8229 380.35641:23228 381.3605:6405 392.39276:74747 393.39636:20023 408.39169:8625 420.90207:3805 572.5827:21310 573.58826:10124 588.57538:17347 589.57996:4718 590.59247:31151 591.59784:11204 620.60413:38609 621.60974:14734,680.62616,680.62616
M691T845,690.6102316,845.087,0.412285552,0.405107974,1.09576116,NS,0.515492837,0.131933373,0.392429208,neg,2.786523614,4.819632196,3.633290162,3.291454714,2.419532866,1.687976882,2.57196328,1.738167933,1.467012324,2.897954329,2.601029709,1.550546698,3.89876585,1.984133928,4.003606204,3.890288661,2.2479698,3.123327577,1.487762303,3.447310623,3.032528465,2.2375888,1.399485482,3.212691869,2.569803142,3.938959644,1.858001878,0.751400047,3.622284349,4.209123252,2.214103764,3.361785918,2.689466879,2.886334224,5.373286971,3.060188953,2.435692097,2.445488517,4.105539514,2.490946199,2.636489858,2.96136659,2.722302925,2.358636465,2.127645816,1.214602068,2.386212466,3.155029344,690.6067785,690.6136846,Ns,Cer 42:3;O2|Cer 18:2;O2/24:1,D,690.61047,14.088,6785,[M+HCOO]-,C42H79NO3,Cer_NS,RWMLFFULUMHLPQ-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,61.5,68.2,690.61047:847095 691.61382:610673 692.61718:152287,50.81678:2815 59.01267:14105 60.09035:3247 65.7964:2611 69.09701:2762 101.88656:2875 153.17406:3155 153.18817:3321 207.52409:3119 235.20784:11921 237.06474:3986 261.22623:5465 262.22769:3158 347.33414:12221 364.36139:7819 365.34384:4825 390.37732:43466 391.38162:13101 480.73032:3497 596.58105:6910 614.5849:3875 644.60596:7231,690.61047,690.61047
M693T871,692.6259668,871.442,1.210686043,0.001534721,0.654167701,NS,0.006151228,-0.612267566,2.813970629,neg,3.546081427,4.971918714,2.060705842,2.615479486,4.323618542,0.980847101,2.757301666,1.413322797,1.266064877,1.993043699,3.129050714,2.263226513,3.120349813,3.8090596,2.993516161,1.250771422,2.302606511,2.482903977,2.452789423,2.553117236,3.562811628,4.808190242,2.772281417,6.05530935,2.662347082,4.279205589,2.102924502,1.443844645,2.843788812,2.630157508,1.030749711,4.574475344,3.531640883,4.085385441,6.140025149,3.771288414,1.826102095,1.819358043,2.306865022,1.087921999,2.437636441,1.689341562,0.932602841,3.027643146,2.59210838,1.781172323,2.173572074,4.459255817,692.6225037,692.62943,Down,Cer 41:2;O2|Cer 18:2;O2/23:0,D_POS,692.62628,14.536,6806,[M+CH3COO]-,C41H79NO3,Cer_NS,YVMFSKMDQVDKIS-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCC,53.2,74.3,692.6264:2112123 693.62975:1176789 694.63311:293652,57.03349:4934 57.97468:2956 59.0127:440164 60.01601:11161 61.80329:3104 61.984:5332 61.98724:110787 79.91431:3246 116.97198:5194 134.01942:2924 146.96606:3484 217.00433:3620 219.97859:6009 235.20778:71746 236.21106:10673 237.22307:4768 241.33833:4200 261.22357:34387 262.2247:7021 264.23395:16799 304.73083:3741 335.29346:5764 335.33405:84697 336.33707:14722 351.36584:12085 352.36191:44794 353.34174:23180 354.34988:4280 378.37692:244844 379.33057:6478 379.37943:67563 380.32617:4679 380.3833:6310 392.39047:4069 394.37198:25110 395.37616:7050 507.52487:4054 584.58398:22384 585.58356:11193 600.57257:10622 601.57959:8199 602.59338:20687 603.59448:12896 632.60413:29038 633.60632:14975,692.62628,692.62628
M693T888,692.6259273,887.628,0.980767813,0.004539718,1.353329012,NS,0.01481291,0.43651262,2.342971087,neg,3.374273254,6.496478685,5.415781106,5.725308436,3.580329389,4.042258733,3.926260075,2.8182341,2.764319285,6.979910564,3.950138072,3.097931416,6.724994677,2.573876502,5.496427363,9.174729952,3.322306367,4.093792371,2.253879152,7.542025019,5.464985182,3.577035525,1.770957203,4.131518879,3.516042057,8.64812976,4.601626508,1.536937951,5.802066487,8.023700982,5.05573397,3.893868256,4.725754257,7.728879215,4.598525507,4.58047884,5.753813612,5.228604625,8.099340521,4.643225097,7.449208151,6.716338376,5.388133024,3.807140889,3.401473551,3.980714522,4.373987413,4.372077238,692.6224641,692.6293904,Ns,Cer 42:2;O2|Cer 18:1;O2/24:1,D,692.62659,14.781,6807,[M+HCOO]-,C42H81NO3,Cer_NS,VJSBNBBOSZJDKB-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,59.9,77,692.62659:930686 693.62994:549157 694.6333:115871,59.01274:19966 61.9871:18146 69.04909:2657 89.3296:3508 101.60567:3241 116.97147:8339 119.94629:3784 127.88012:3418 174.71417:3244 177.13873:3600 190.19695:3156 202.5408:3024 219.97842:6410 237.22333:22078 238.22879:4409 252.25528:3415 263.23868:8809 266.25232:4905 268.26483:4354 276.80701:3445 305.53879:3232 347.33484:12255 364.36172:7620 365.34583:5479 390.37698:70186 391.38043:14209 406.3721:13081 455.67371:3747 598.59595:4147 614.5929:4493 616.60809:7360 646.62024:10535,692.62659,692.62659
M695T911,694.6418699,911.179,1.277240677,0.000289983,0.707315889,NS,0.001549687,-0.499573426,3.53762714,neg,12.65578139,7.170500325,8.439389803,14.16349254,20.65805127,7.868793117,10.67470988,10.16807159,5.59612588,8.607666749,14.90982486,17.06017071,14.77459704,15.23987107,7.521162397,12.07063426,5.329670835,8.576392162,15.60075091,16.90719258,16.10915253,20.92621852,14.36486049,15.26171484,11.48685192,15.42858623,8.771387684,16.15970252,9.14224518,12.26642361,8.131910965,13.45230977,22.83484864,21.17865356,10.92827808,16.5196643,11.11189898,8.502703152,9.19300871,5.549522209,13.64737081,10.44555823,7.608013001,15.64054607,8.193533746,14.70136703,14.94249864,16.83985949,694.6383967,694.6453431,Ns,Cer 41:1;O2|Cer 18:1;O2/23:0,S,694.64221,15.186,6833,[M+CH3COO]-,C41H81NO3,Cer_NS,NAJHAHQNQCNWOP-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCC,56.2,89.7,694.64221:1321307 695.64556:659782 696.64892:181794,119.94585:5898 123.21645:4407 143.99152:5182 146.96556:5388 157.98746:3302 174.99327:6650 201.02618:3869 202.98801:38955 217.00417:96309 218.00761:4554 219.97852:3968 223.20726:29782 235.20697:6443 237.22353:137613 238.2262:16913 239.2383:4191 249.2235:14120 252.23444:5500 263.23972:72711 264.24243:12693 266.25055:30396 267.25223:4876 268.26654:7021 270.18784:3841 284.9917:5986 286.84171:3958 299.00772:9266 335.29288:6557 335.33417:114874 336.33713:21071 349.35071:21361 350.35223:5727 351.36453:19846 352.36115:88718 353.3421:55665 354.3486:15926 366.37747:18829 367.36496:11003 378.37677:434600 379.32977:6857 379.37943:121555 380.32993:4285 380.38058:6921 392.39319:86577 393.39609:20542 394.371:56626 395.37415:10987 396.34985:10319 406.40649:5895 408.38654:8311 409.39191:4545 586.59668:57589 587.60132:25670 602.59241:44984 603.59882:19659 604.60791:69892 605.61285:28431 634.61914:214416 635.62268:118509 636.62323:9602,694.64221,694.64221
M699T732,698.5189476,732.427,1.517038044,0.000100691,0.514590413,NS,0.000643703,-0.958503514,3.997009712,neg,2.183025297,5.568871605,1.378748781,1.414463325,3.093144332,2.532083193,6.076943114,1.707805362,0.612449482,1.654300509,4.654164334,2.588518214,1.705501479,4.410535534,0.873813967,0.507532765,2.471947382,1.5496883,4.171787209,1.368291692,0.985374228,3.56419669,3.886312698,5.85595763,1.953206559,3.481289941,5.387378025,0.923431932,2.052789022,3.842133207,0.536821806,5.504744489,1.747230671,2.301295927,3.514134127,3.164733183,2.280871929,1.41966995,3.231413115,1.539772802,2.515130947,1.566558987,1.169123909,3.428881993,3.852639691,3.628612742,2.018994992,6.310006781,698.515455,698.5224402,Down,PE O-34:3|PE O-16:1_18:2,S,698.51935,12.213,6904,[M-H]-,C39H74NO7P,EtherPE,LJVXDBWIBQQKFU-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,66.4,45.3,698.51935:4360038 699.5227:2890992 700.52606:823628,59.0127:520506 59.11108:4710 60.32374:5081 61.98719:12071 69.68423:6197 78.95802:260157 79.80246:4446 80.67446:4833 91.34035:5108 122.00063:13709 137.00067:7832 140.01129:119847 163.01685:26206 170.86838:6958 179.03574:15135 196.03839:72573 217.6111:5830 239.23982:75932 240.24338:14249 245.27852:6486 255.23457:22278 256.23691:5259 261.22403:16950 278.24002:6154 279.23465:2418891 280.2381:452519 281.24283:20321 375.23517:9705 376.23749:5094 418.27634:53465 419.27884:12675 436.28656:112482 437.29111:25494 441.06519:5451 539.26886:5366 642.82855:5684,698.51935,698.51935
M703T788,702.5493857,787.7225,1.458771311,6.29E-05,0.586905664,NS,0.000435774,-0.768799464,4.201220674,neg,2.982934769,5.112283474,2.298577607,2.664782624,6.212832546,3.377531985,3.390859743,1.696020762,0.851664472,1.857860367,3.546777383,2.929442701,2.135951537,4.366306657,1.620942723,1.225683651,0.831496784,1.616998135,4.226524444,2.779392752,0.89999059,4.560343764,3.233861746,3.87322687,3.822826999,3.233458784,5.230002003,1.33522217,1.90117011,3.231901514,1.265661637,6.459238193,2.504508983,2.384837362,2.8822287,3.090655325,1.764664304,1.992465512,3.809795451,1.458156508,2.643014627,1.384776857,1.63992353,3.609010456,4.477975348,3.037881441,2.243671947,4.335071069,702.545873,702.5528985,Down,PE O-34:1|PE O-16:0_18:1,S,702.54956,13.128,6951,[M-H]-,C39H78NO7P,EtherPE,JJGMGPGKWYLISM-UHFFFAOYSA-N,O=C(OC(COCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,27.3,44.6,702.54956:412106 703.55291:294312 704.55627:77068,52.62144:3023 53.62258:2632 54.10923:2558 54.50568:3128 54.62075:2980 58.85028:3075 59.01271:211066 60.76625:2949 61.98722:9258 66.45132:2660 67.46716:3435 73.59569:3275 75.53947:2861 78.95799:24971 87.33235:3246 89.06173:3227 102.42348:3735 140.01151:11527 141.01646:3816 141.54521:3353 148.68944:3069 155.7621:3745 174.99252:7669 217.00394:38097 218.00568:4291 250.73442:3540 253.21857:8893 255.23453:134831 255.26151:6943 256.2381:23476 281.25018:136454 282.25443:24107 321.33838:3289 374.99466:7937 407.32172:3555 417.85727:3896 420.29465:6420 438.29825:5177 446.31015:4969 464.31445:7548 694.44629:4343,702.54956,702.54956
M703T801,702.6096304,801.029,0.893510979,0.03280858,0.681281328,NS,0.071916751,-0.553677428,1.484012563,neg,2.370023294,3.943437421,2.753268574,1.689078416,3.504187449,1.798445549,3.186331523,1.322731864,1.347468252,2.155946231,2.221726985,1.472412435,2.496915759,1.819978074,2.174744118,0.662208129,1.811211336,3.967602637,1.708560378,1.672678932,2.29161234,2.45023326,1.947658067,3.812989535,2.383171439,1.281228053,2.021268248,0.805394881,2.070619148,3.601051382,1.482916279,5.369483575,2.790935843,2.833296152,8.02195611,3.328587539,1.700505239,1.033044488,1.330877463,0.968514561,2.38572064,1.234349373,0.808983056,2.199857919,2.067600677,1.274689206,1.498865726,3.608787017,702.6061173,702.6131434,Ns,Cer 42:4;O2|Cer 18:2;O2/24:2,S,702.61035,13.355,6954,[M+CH3COO]-,C42H77NO3,Cer_NS,VVROVHFWHBBWFZ-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCC=CCC=CCCCCCCC,48.7,63.2,702.61041:324656 703.61376:198501 704.61712:34322,56.35127:2852 59.0127:342326 60.01611:5845 61.53234:3148 61.98732:3669 97.27437:3191 99.30063:3205 108.50505:3619 132.54767:3504 134.11073:3201 136.77043:3532 163.27579:3599 217.00323:7962 235.20746:24512 255.2347:6387 261.22385:10307 264.23419:5528 281.25177:4326 285.78131:3530 345.31845:13056 362.34467:12398 363.33044:7850 388.36136:83493 389.36493:20656 404.35608:4118 538.68573:3783 594.56873:7979 595.56952:5133 612.57916:4901 642.58929:5914 668.00293:4252,702.61035,702.61035
M705T845,704.6256827,845.08,0.365615071,0.493790161,1.081417197,NS,0.600286065,0.112923204,0.306457567,neg,2.486539893,4.939435876,3.409827857,3.151282066,2.253330375,1.644157587,2.490121867,1.6223312,1.364234594,2.811260857,2.547629804,1.428559231,3.811957212,1.868226982,3.753214807,3.947813485,2.019605266,2.955422427,1.382923988,3.1862158,2.796877692,2.10603954,1.326897151,3.114000296,2.343675395,3.849484867,1.808090314,0.730076566,3.511405123,4.076161194,2.178980655,3.192657197,2.556037956,2.56465671,5.172615949,3.012993043,2.290342293,2.259834144,4.139594637,2.386084923,2.397092252,2.940056034,2.546327141,2.216891432,2.019411249,1.217867753,2.229948995,3.09227387,704.6221595,704.6292058,Ns,Cer 42:3;O2|Cer 18:2;O2/24:1,D,704.62598,14.088,6987,[M+CH3COO]-,C42H79NO3,Cer_NS,RWMLFFULUMHLPQ-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,46.5,73.8,704.6261:9698052 705.62945:5322990 706.63281:1407967,54.84949:2876 57.22414:2848 59.01269:438811 60.01609:10137 62.07997:2818 63.53219:4013 66.43374:3153 66.64643:3006 69.22687:3109 77.38319:3577 87.35555:4578 157.972:4425 196.32678:3433 235.20787:79379 236.21103:12324 237.22308:5145 241.28662:4323 261.22406:36503 262.22742:10958 264.23511:19609 265.23767:4082 266.24884:5541 331.43982:3517 347.33398:67368 348.33719:13683 363.32993:4416 364.36105:43424 365.34177:22560 366.34937:10279 388.36115:9272 390.37708:278169 391.2373:6325 391.38019:64878 406.3721:22422 407.37326:8606 596.58246:14172 597.58905:16833 609.51642:5413 612.57709:14797 613.57654:7866 614.59583:23191 615.59735:10909 627.52771:51491 628.5274:12626 644.60474:31389 645.53595:14886 645.62177:7958 685.92261:3945,704.62598,704.62598
M707T887,706.6414865,887.361,1.132506097,0.000871331,1.499608791,NS,0.00387569,0.584586188,3.059816713,neg,3.167960483,6.471898248,5.72212803,6.062075842,3.513026277,3.48851969,3.774863458,2.840378573,3.574522837,6.58822943,4.280142644,4.332315992,7.112875875,2.196035727,6.574452472,10.32173188,2.904094392,4.296763774,2.114244746,6.058945411,5.842359632,3.234633482,1.388850426,3.325711169,3.786305023,8.960465114,0.391273838,2.233586864,6.244917968,8.385152252,5.388211799,3.6018129,4.678470427,3.769272479,4.434534312,4.84881415,5.987379635,5.586723223,8.407062456,4.921902179,5.500108247,7.068282485,6.020245726,3.592315848,3.531304956,2.260822694,4.537934254,4.208325691,706.6379533,706.6450198,Ns,Cer 42:2;O2|Cer 18:1;O2/24:1,D,706.6416,14.774,7009,[M+CH3COO]-,C42H81NO3,Cer_NS,VJSBNBBOSZJDKB-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,40.9,70,706.64178:12570940 707.64513:7244262 708.64849:1873362,58.68911:2740 59.01271:146545 61.98722:52710 78.70088:2998 85.17537:2964 119.34549:3358 146.96561:8047 147.19113:3509 176.18707:3068 176.78763:2939 217.00385:11613 219.97827:19855 237.22342:24546 238.22742:3983 263.23926:15677 266.24887:5422 347.33484:17458 348.33841:4108 361.2485:3706 364.36032:12533 365.34152:4881 377.97253:5447 390.37698:72154 391.38074:20893 406.37012:7321 598.59589:4491 616.60883:8151 617.61334:5237 627.52759:19071 628.52625:7901 629.52588:3710 645.53668:6515 646.52985:4784 646.62323:9128 647.62604:4946,706.6416,706.6416
M709T930,708.6574012,930.4145,0.982493535,0.004015934,0.758479562,NS,0.013381849,-0.398817789,2.396213469,neg,15.59811515,8.4957611,10.10492609,18.51780101,19.60305328,9.574189491,18.37444182,13.63443301,7.065225236,11.36553266,17.5859938,19.53681938,19.76152578,17.58080112,8.714215624,11.06096859,5.669617677,9.654422108,25.76790658,19.42154816,20.91455233,19.9023508,22.03554855,20.41281182,17.10068545,12.86608565,8.968862171,17.87083608,13.1677134,18.04138177,11.07739467,14.63712525,23.27663022,32.33851086,12.38685521,21.98382974,14.5474433,10.15446632,10.71988312,7.795184894,21.23552253,13.14278033,10.31052056,21.27623266,12.87507297,20.63077919,20.66868288,20.69628461,708.6538579,708.6609445,Ns,Cer 42:1;O2|Cer 18:1;O2/24:0,D,708.65814,15.505,7032,[M+CH3COO]-,C42H83NO3,Cer_NS,ZJVVOYPTFQEGPH-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC,58,85.1,708.65814:4155510 709.66149:2189798 710.66485:537617,99.88419:3846 112.10542:5953 146.96567:5533 174.99257:28804 217.00383:338736 217.03951:14876 218.00714:27877 218.27087:4004 219.97826:12050 225.224:5247 235.20761:18337 237.22348:464997 238.22714:74449 239.2383:16285 250.08774:4304 250.25574:14498 263.23953:250354 264.24283:49511 266.25037:90073 267.25369:16518 268.26587:31114 269.26849:6701 281.24878:5956 294.24567:4962 298.27692:10604 299.00757:46375 347.33414:8581 349.34979:414937 350.35315:116609 365.3815:48562 366.37677:261305 367.35782:175954 368.36331:52849 378.3764:8143 380.39029:6286 390.37671:14109 391.38641:5087 392.39236:1494170 393.34216:52653 393.39514:425647 394.34332:13149 394.39944:22974 406.371:13265 407.37476:8092 408.38724:170250 409.3913:43771 410.36139:23999 521.69818:4389 527.91333:4588 600.61365:149032 601.61646:91107 602.62598:7830 616.60834:97131 617.61194:60366 618.62347:167094 619.62762:82529 620.62964:9738 629.52618:5970 631.62787:6293 648.63495:484070 649.63812:243910 650.63971:25736,708.65814,708.65814
M713T762,712.5341912,761.567,1.290966584,0.001330002,0.509912781,NS,0.005478638,-0.971677595,2.876147866,neg,3.918277432,5.81319795,0.642326655,2.019258871,1.959027793,2.946969941,4.408481228,1.366811097,0.610832774,0.983190437,5.682489085,2.029171088,1.787775087,4.01272947,0.77654421,0.411964796,2.508830423,0.852102007,3.162264605,1.86145453,0.560443014,2.053360422,1.9371015,8.437089975,3.196849428,4.681854089,6.344509494,1.005008253,1.502609147,2.723425681,0.327922227,3.858012939,1.831170519,2.399465822,2.756276193,2.845901845,1.200189744,1.459212947,4.200658432,1.321742739,1.698441424,1.734894552,0.837072478,2.565224902,2.126977844,3.443321491,1.472421306,5.721856733,712.5306285,712.5377539,Down,PE O-35:3|PE O-17:1_18:2,S,712.53552,12.701,7096,[M-H]-,C40H76NO7P,EtherPE,ISXPJSRNZVJVPZ-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,64,44.7,712.53503:295155 713.53838:121717 714.54174:42039,59.01268:8377 60.61839:2675 69.87725:4552 75.22978:3144 78.95795:26695 91.06351:3232 91.86253:5983 129.03381:3576 140.01111:12840 186.00874:3861 188.5087:3380 196.03787:5980 253.2552:6540 279.23471:226058 280.23801:38297 294.07623:3434 315.04321:3285 432.28821:5897 450.3042:9880,712.53552,712.53552
M715T704,714.5138907,703.547,0.332113865,0.769819362,0.960046067,NS,0.832150538,-0.058824461,0.11361117,neg,1.178758508,2.271037002,1.527651248,2.875031834,3.721191659,3.528104483,6.921831499,1.631751755,1.877171897,4.166364836,2.21799053,2.721780333,4.153202201,1.371944091,1.541547463,2.87094786,2.288798849,2.963612026,2.558836862,2.804839621,1.421748941,3.854735295,2.596856236,5.318067074,1.8862585,2.660486078,1.925007331,2.054656168,3.290661342,2.670871906,2.411236445,2.696397359,2.306961198,1.59707781,2.71017926,2.010911799,2.46079517,1.303482633,3.325460819,3.815756804,3.435376574,1.810422656,2.951461833,2.91768942,8.212788125,1.758759003,4.746268456,3.816364482,714.5103181,714.5174632,Ns,PE 34:2|PE 16:0_18:2,S,714.51447,11.733,7119,[M-H]-,C39H74NO8P,PE,HBZNVZIRJWODIB-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,75.7,46.8,714.51447:4356908 715.51782:2321236 716.52118:539884,51.32416:2916 56.56167:2747 59.01266:9320 69.24078:3273 70.91251:3027 70.94474:2806 77.43974:3365 78.958:33321 96.96841:3609 102.54288:3440 111.90202:3579 122.00052:5101 140.01149:42846 183.29559:3481 196.03799:26513 226.26556:3582 253.21938:5285 255.23441:224484 256.23801:40969 279.23465:485973 280.20944:7096 280.2381:87976 281.24979:7044 357.5834:3749 452.28076:4815,714.51447,714.51447
M717T753,716.530008,752.886,0.573250105,0.119906618,1.23133243,NS,0.199541322,0.300220307,0.921156847,neg,1.169526866,2.412079632,2.530772807,3.105476586,2.819966491,3.023754459,5.346645478,1.884118928,2.312855549,3.557694377,1.96894549,2.595041919,3.388555547,1.016084315,2.205699317,7.602502489,2.351029946,2.214742566,2.481980528,2.990639335,1.330565887,2.671275632,1.557503535,3.742889225,2.330765582,2.417958645,1.060741595,1.911395511,3.701515515,4.032502852,3.543549916,2.452060056,1.762550769,1.645053634,1.749326905,2.683449077,1.829217936,1.704406686,5.507094818,3.250642921,2.542206601,2.334626085,2.736936691,1.899150931,6.24177913,1.8331196,4.485188317,2.43567059,716.5264253,716.5335906,Ns,PE 34:1|PE 16:0_18:1,S,716.53033,12.563,7144,[M-H]-,C39H76NO8P,PE,FHQVHHIBKUMWTI-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,76.2,45.1,716.53015:1495247 717.5335:645270 718.53686:174718,59.0127:15129 69.89048:3427 78.95803:23923 91.86322:5817 100.21807:3977 122.00014:5994 140.01131:35013 196.03864:14975 253.21915:6216 255.23439:157545 256.2373:26983 281.25031:358168 282.25375:60007,716.53033,716.53033
M721T674,720.5034277,674.191,0.846879027,0.018379992,0.606778682,NS,0.045020846,-0.720757694,1.735654692,neg,2.585319942,3.590719148,0.663934949,2.79834837,3.179578168,1.116186023,6.1069036,0.477315279,1.075116522,0.594248377,1.977371979,4.347139012,2.916674629,6.187058806,0.772395433,0.470010512,5.543854948,1.499186406,3.574587441,2.769291773,0.358407402,2.680084172,1.81249325,2.870037672,2.56509064,8.746220604,5.816018637,0.562882348,0.655146868,3.746751666,0.562523608,2.520383342,1.475453624,1.73381071,2.282626196,1.725429719,0.556736257,4.290814654,4.593723496,1.200937305,1.277276873,1.562617285,0.24842454,1.110481998,0.977076466,2.750227977,0.883495134,3.109197871,720.4998252,720.5070302,Ns,PE O-36:6|PE O-16:1_20:5,S,720.50403,11.244,7188,[M-H]-,C41H72NO7P,EtherPE,RLLOITCRNQRGJD-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCC=CCC=CCC=CCC=CCC=CCC,41.8,49.8,720.50403:1658140 721.50738:1093158 722.51074:248061,50.93852:2409 52.73373:2471 55.66492:2666 59.01271:30549 62.79598:2629 78.6636:2641 78.95809:31573 91.86299:3190 140.01164:13537 156.49095:3403 196.03828:15885 239.23846:6463 257.229:9216 285.51471:3806 301.21967:34931 302.22311:3389 311.05185:4781 371.85483:3945 418.27438:6642 436.28665:11869 523.98615:3571,720.50403,720.50403
M721T907,720.6579376,906.7495,1.081597164,0.006286655,0.684834829,NS,0.019085635,-0.54617202,2.201580371,neg,2.132563095,5.367779361,3.461307631,4.280129555,5.186630605,2.177636041,3.995782998,2.25149195,2.018711383,3.094737037,9.692261251,3.384530543,3.655082692,2.490668785,2.569660959,4.192414678,1.735323581,3.220618761,2.295846859,4.359133186,3.555975352,3.099143179,1.6330131,4.900069418,2.282923394,5.285972493,4.331562137,1.818075149,3.276054944,5.719968471,2.480324758,3.305961304,5.346762979,2.167700189,3.428368632,4.93513603,4.08071738,2.476499013,2.915009331,1.880911576,2.613654508,2.891796665,2.349920237,1.992591158,1.920286901,3.958091993,2.642954375,6.719055831,720.6543343,720.6615409,Ns,Cer 43:2;O2|Cer 18:1;O2/25:1,S,720.65833,15.102,7193,[M+CH3COO]-,C43H83NO3,Cer_NS,AHNGOTQGIJOINE-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCC=CCCCCCCCCCC,46.8,69,720.65833:328318 721.66168:207981 722.66504:55682,52.26205:2557 53.23136:3647 53.33955:2364 53.4744:2314 54.91722:2652 56.58361:2794 57.38215:2760 59.01269:83717 59.06683:2879 60.27798:2660 60.33808:2382 61.17978:2945 61.98722:23999 69.14558:2723 77.85967:2654 82.5722:3349 85.96625:2939 87.07182:2948 87.42352:3160 87.48035:3381 90.93606:2846 98.85619:3815 143.99118:5607 146.966:9729 178.06551:3164 217.00336:9600 235.20905:4629 237.22263:9529 238.22806:4143 240.96539:4905 247.2411:3918 263.23975:3906 273.65515:3589 313.86844:3315 361.34924:6806 378.37628:4485 379.47894:3716 390.37686:7336 404.39178:26823 405.39697:10419 406.40866:10274 630.62488:4804 660.63635:9131,720.65833,720.65833
M723T719,722.5187093,719.198,0.929907388,0.028615216,0.733822008,NS,0.064441033,-0.446497922,1.543402969,neg,2.626216307,4.92487436,2.319821395,0.862543649,2.700814084,2.001263614,4.360171847,2.275985681,0.833022368,1.728958356,2.19657923,2.7283934,1.944042665,3.444520733,1.918118279,0.745702244,3.029322887,1.284449729,3.909754104,0.858373674,1.021022041,3.804761007,2.746678608,3.281280724,2.478710848,4.121916381,3.987736545,0.588686205,1.690419531,5.146703238,1.429822244,4.594368617,1.438521964,3.188054751,2.450115532,4.146466946,1.797859843,2.702577455,3.779508371,1.42939891,2.390849033,1.558140024,1.162775044,2.825347647,2.648332225,2.683381574,1.380677874,4.114793644,722.5150967,722.5223219,Ns,PE O-36:5|PE O-16:1_20:4,S,722.51904,11.99,7211,[M-H]-,C41H74NO7P,EtherPE,YITZQGLIICATLN-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,51.9,49.6,722.51898:22020042 723.52233:14058866 724.52569:3680896,57.03362:6516 59.01271:102478 64.57334:7023 64.97028:5862 71.01295:7557 78.95804:261632 83.04941:8603 85.31731:6190 101.35883:7102 107.42549:6300 122.00043:18508 122.98566:7774 137.00041:15910 140.01137:127746 152.99544:13561 163.01636:21438 177.09297:12439 179.03506:12896 196.03862:109113 199.19762:7325 205.1969:21876 231.2135:12726 239.23895:86555 240.24197:19393 249.62373:6193 259.2449:83432 260.06885:6471 260.24814:17652 279.2363:8028 285.22476:13622 303.23495:718657 304.23874:134635 305.24054:10917 328.6824:7254 375.23209:12493 418.27521:42665 419.27789:9667 436.28665:110943 437.29025:28997 573.72412:7569 658.80127:7045,722.51904,722.51904
M723T942,722.6736488,941.727,1.306387605,0.000723506,0.445248426,Down,0.003337619,-1.167317584,3.140557786,neg,6.21107167,3.847802692,1.917221698,5.70876979,12.80766481,2.197469867,13.22612876,3.361460868,2.36234553,2.885496773,6.365658721,11.24142878,5.480889662,10.79970065,1.203427709,4.810250332,2.096145931,1.661548062,6.424308264,5.959419647,3.140092339,10.95344889,3.58934802,29.07600729,5.474661895,18.43198604,5.591597647,4.469689899,5.660645966,6.45037148,8.219730223,10.00735537,9.206822138,4.457495218,6.920427063,10.21736497,4.203475829,3.051123599,2.466780067,1.915844029,4.04306827,5.349709484,2.481307631,3.943910295,1.936382533,11.20324134,4.443852994,14.66453993,722.6700354,722.6772621,Down,Cer 43:1;O2|Cer 19:1;O2/24:0,S,722.67419,15.687,7217,[M+CH3COO]-,C43H85NO3,Cer_NS,KSYIVRBEJSMJMX-UHFFFAOYSA-N,O=C(NC(CO)C(O)C=CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC,54.6,75.4,722.67413:514688 723.67748:290786 724.68084:98305,57.3845:3089 58.60211:3160 59.01271:171832 61.98733:21988 64.13282:2868 69.03326:4613 74.00912:3578 77.7145:3201 84.3183:3110 91.86827:4360 92.58839:3223 112.14957:3832 139.61304:3385 146.96553:10720 149.31059:4147 192.82462:3056 217.00359:5633 219.97868:3192 251.23975:39497 277.25635:18275 280.26523:6525 349.34918:34960 350.35269:8217 365.38361:6363 366.37634:17068 367.36191:13514 392.39279:124535 393.34772:6072 393.39499:30076 406.41028:8484 408.38675:10246 462.65018:4259 550.68329:4359 614.63025:9359 623.08124:4108 630.62646:6616 631.62115:4388 632.64001:14528 662.65448:15045 663.65247:7720,722.67419,722.67419
M725T734,724.5349167,734.118,1.107805233,0.006760128,0.661980726,NS,0.020229912,-0.595138883,2.17004506,neg,2.939290098,4.840699807,1.612165884,0.987778822,3.891070012,2.405702774,4.465766413,2.23665632,0.694127611,1.579435607,2.960590759,1.985784175,2.046213321,3.924107109,1.285621755,0.732635059,1.831539904,1.961841935,3.399959467,0.958367476,0.989061082,3.736590627,3.505584019,3.723872191,2.869677005,3.630501975,4.648873398,0.761478609,1.505672051,4.118254742,0.808448538,5.541916312,1.806756437,2.762302261,2.458506405,2.571262956,1.725487344,2.04432438,4.106873298,1.419101123,2.757623853,1.405422676,1.33698178,2.939548739,4.451138217,2.807792158,1.544916076,5.484081039,724.531294,724.5385393,Down,PE O-36:4|PE O-18:2_18:2,S,724.53552,12.241,7233,[M-H]-,C41H76NO7P,EtherPE,ULUBTSXVFBWWEF-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,63.2,44.5,724.53552:3715538 725.53887:1813986 726.54223:450170,50.80722:3315 54.72971:3588 59.01268:48333 70.7201:3772 78.95804:129005 95.15685:4259 109.54368:4060 122.0006:10601 128.47896:3620 132.05176:4383 137.00046:6892 140.01137:77161 152.99562:4685 163.01584:13370 166.02785:4170 178.0282:4320 179.03429:5094 187.91463:4517 195.55595:4151 196.03845:53507 197.04204:4594 234.70578:3803 261.22406:7706 265.25583:25752 279.23468:1443126 280.23813:266519 281.25012:57707 282.25372:9467 303.23584:32358 324.44708:3998 444.29257:35041 445.29788:6436 462.30215:64352 463.30478:17044 677.38:5050,724.53552,724.53552
M727T789,726.5506128,788.986,1.364639475,0.000570338,0.580686738,NS,0.002731963,-0.78416801,3.24386746,neg,2.476875317,4.690662513,1.174553821,1.156253972,3.362929678,2.443658106,4.386319905,1.748310735,0.579368766,2.084440349,4.765554115,1.975833303,1.512605981,3.46410754,0.923286402,0.680016516,1.806934469,1.409241998,3.175980808,1.119731974,1.145984119,2.9685284,4.026925374,5.973484975,1.841892031,3.241907982,4.82938788,0.83459119,2.290933803,2.572550787,0.566688564,5.266021861,1.906850556,2.287970136,3.782731393,2.767292727,3.093016909,2.079868738,2.993966067,2.044554609,3.065904245,1.557364829,1.274374928,3.207779799,3.941324155,3.346516058,2.139591584,5.311773216,726.54698,726.5542455,Down,PE O-36:3|PE O-18:1_18:2,S,726.55066,13.155,7254,[M-H]-,C41H78NO7P,EtherPE,XVXISDREVDGQPX-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,65,45,726.55066:9363670 727.55401:5099684 728.55737:1384889,52.62203:10125 59.01269:226990 63.53802:10371 66.77373:12071 67.54659:9473 69.68432:15668 78.95805:603828 122.00063:36915 137.00063:29660 140.01138:337747 149.60133:16837 152.99532:22172 163.01637:40612 166.02777:15286 179.03519:46041 180.99422:11975 196.03839:220546 258.3436:11781 261.22675:28520 267.27063:165894 268.2746:35481 278.23914:18582 279.23471:6503138 280.23816:1293790 281.24997:158180 320.28549:12129 403.26498:20851 446.30682:170605 447.3107:52249 458.10431:14220 464.31824:333818 465.32034:65515 571.10645:14116,726.55066,726.55066
M729T830,728.5664952,830.432,1.074744485,0.012299018,0.718709841,NS,0.032598763,-0.476518654,1.910129564,neg,2.089886673,5.173267241,1.697957487,1.505858611,2.819582145,2.873369104,4.801011381,1.748338644,0.651731871,1.984839776,3.433377342,2.59857669,1.738119855,3.341074666,1.440687357,1.469814737,2.772182783,1.68457904,3.609736604,1.426373673,1.189638034,2.874519664,2.657901489,5.945985853,2.357973627,3.505120047,5.090457674,0.831222015,2.772673124,3.66295292,1.45836139,4.776484818,2.033814497,2.694916339,2.410206787,3.357924806,2.985090136,2.345499653,4.006784572,2.257593655,2.483865133,1.894596913,1.703436013,3.798344952,4.038472573,3.187889478,2.588439902,3.614372609,728.5628523,728.570138,Ns,PE O-36:2|PE O-18:1_18:1,S,728.56702,13.852,7280,[M-H]-,C41H80NO7P,EtherPE,XVYPOHCSLJZFED-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,57.2,44.2,728.56696:2258374 729.57031:1151244 730.57367:308828,59.01276:31642 61.38309:2815 61.98721:11746 71.75855:3647 72.76542:2801 75.55389:2828 77.26124:3358 78.95805:48977 101.81487:3361 104.29856:3591 115.2085:3160 121.8696:3943 140.01138:23238 153.70044:3415 155.15858:3647 161.72385:4064 163.01668:5700 169.20778:3042 179.03607:4941 184.85982:3483 196.03879:13901 217.00429:3661 255.23473:23236 267.27042:18760 279.23569:7788 281.25037:490374 282.25397:85532 283.25974:8871 309.28232:48525 310.2854:11865 446.30643:10081 464.31943:19657 465.31915:4381 611.3725:3346,728.56702,728.56702
M732T507,731.5414523,507.291,1.420300275,0.000184724,0.65444289,NS,0.001057359,-0.611660794,3.733477094,neg,2.783873279,3.914531571,1.979700448,3.432865313,3.888086903,2.50106294,4.187338875,2.054082707,1.572724655,1.746266671,2.94104834,2.413999392,1.591634616,2.891951846,2.005547422,1.278044071,2.328516149,2.834510002,2.288070975,3.39752018,1.52089199,2.865523831,4.103771874,3.755728521,2.828585408,4.183828987,3.594604611,1.482949815,2.887158161,3.308847924,1.605590027,5.969911606,2.838303252,1.464151784,5.244232855,3.269414045,1.792987038,1.558603198,2.981577375,2.14803765,1.332557293,2.420151322,1.625600344,2.379454426,2.045899012,2.073410175,2.529029754,2.339962096,731.5377946,731.54511,Down,SM 32:2;O2|SM 18:2;O2/14:0,S,731.54199,8.446,7309,[M+CH3COO]-,C37H73N2O6P,SM,AZMHJTIGIHIMFP-UHFFFAOYSA-N,O=C(NC(COP(=O)([O-])OCC[N+](C)(C)C)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCC,54.3,73.8,731.54187:709508 732.54522:347389 733.54858:92679,112.78371:3198 122.98444:10382 132.98112:9246 137.31583:3326 141.01624:20850 168.04305:467452 169.04663:18252 240.96548:56077 293.94806:7087 317.04099:4189 319.92618:15453 322.97025:42688 404.97229:10451 447.30194:4233 657.50262:259168 658.50629:110123 659.50909:7460 690.40393:3880,731.54199,731.54199
M736T645,736.4988025,644.649,0.192118081,0.884245638,0.964882605,NS,0.919291218,-0.051574671,0.053427074,neg,1.260004849,1.669665857,1.030651533,8.188791224,4.289631903,1.976454844,4.962304925,0.277540424,1.988348882,2.106545626,1.248373954,3.063019983,4.157237489,1.567606093,1.587288458,2.641969123,4.606405368,1.726277348,1.860251638,8.311157299,0.991067168,2.483966034,2.617537101,3.659893127,2.872083765,11.73475064,2.313770774,1.133819081,1.205390415,5.123772575,2.035538271,1.418673623,1.262952129,1.166904196,1.535255396,1.151828302,0.658918491,3.080839467,4.438382563,2.535892428,1.851840639,1.641310937,0.779960213,0.689516736,3.180366881,0.913877258,7.6364846,1.855297695,736.49512,736.502485,Ns,PE 36:5|PE 16:0_20:5,S,736.49945,10.741,7373,[M-H]-,C41H72NO8P,PE,KHLRCNXJXSYNCK-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,57.6,45.3,736.49908:214471 737.50243:107773 738.50579:27809,55.31068:2772 59.01272:7362 61.08319:3023 61.9873:5662 67.99184:3307 78.95808:12778 106.32973:3123 119.61447:2743 122.00072:3708 140.01175:8753 196.0376:7234 201.47108:3296 210.13452:3781 253.06035:3269 255.23427:46512 256.23923:6675 257.22964:4683 301.21915:22285 322.63162:4388 689.91272:5015,736.49945,736.49945
M737T749,736.5348246,748.762,1.640205618,2.18E-05,0.401955549,Down,0.000175416,-1.314892126,4.662354421,neg,2.316054148,5.298971419,1.038961631,0.785333239,3.082773379,1.238071347,4.101663391,1.227437839,0.535723759,0.79228694,2.057158951,3.035688677,1.61240198,4.19870038,1.223073694,0.468335558,1.870101295,0.593112153,4.009578167,0.742403362,0.660898509,3.959585561,2.032344645,3.581583386,3.461684318,2.614062288,4.454530427,1.689924079,0.782400603,1.904975675,1.559682796,3.989515076,1.452039847,1.769504324,3.221967959,5.820404082,0.711435363,1.397997693,1.925643622,0.667516422,2.06610775,1.041591644,0.866659124,2.10401673,1.283254122,7.012105644,0.618612853,3.625550145,736.5311419,736.5385073,Down,PE O-37:5|PE O-17:1_20:4,S,736.53534,12.495,7377,[M-H]-,C42H76NO7P,EtherPE,SUCZWPZZJOWHRI-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,51.6,49.6,736.5351:1149820 737.53845:670535 738.54181:193651,59.0127:35677 78.95801:81204 83.04922:4867 122.00098:6119 132.12349:3410 137.00075:3765 140.01123:42359 162.07628:3093 163.0168:10354 184.37546:4028 184.53081:3685 196.03865:39691 205.19667:9352 222.32562:3227 253.25473:20953 256.27283:4189 259.24466:27026 260.24811:3423 289.871:3780 303.23505:225543 304.23917:44709 432.29312:19766 433.29626:5196 450.30209:42296 451.30511:7369 531.39178:4090 544.65125:4161 614.45135:3516,736.53534,736.53534
M739T653,738.5139535,653.34,0.995338895,0.017981292,0.499495348,NS,0.044196404,-1.001456854,1.745179102,neg,0.576993683,0.079408836,0.941819714,1.740953984,2.680425143,5.048064552,6.304420545,0.915794444,0.099279064,2.508929496,4.525072213,2.906995398,5.165104251,2.585968763,0.708937979,0.644315065,2.065683179,2.07327206,2.670756938,1.619599936,1.877332111,4.26599719,0.234795513,13.26113595,1.608157351,1.486853602,4.212949695,1.362237079,2.528679421,0.310714433,0.914642498,3.339157293,2.204773007,0.796866853,3.131300068,1.89178664,2.705665167,0.194575108,1.581641751,0.151715354,2.517778853,1.40622672,1.726447563,1.585389528,3.779028857,5.340914768,4.35907518,7.541039504,738.5102609,738.5176461,Ns,PE 36:4|PE 18:2_18:2,S,738.51471,10.897,7409,[M-H]-,C41H74NO8P,PE,SSCDRSKJTAQNNB-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,60,30.4,738.51471:337324 739.51806:171689 740.52142:24485,53.88517:3520 59.01284:5339 61.03327:2900 64.92313:3189 69.82368:3296 78.15516:3373 78.95806:5995 84.91642:2911 92.5593:3055 140.01154:7877 188.25443:3307 205.60861:3423 255.23557:3521 277.2189:6910 279.23489:132480 280.23773:22802 322.26288:3253 342.84131:3937 498.49005:3815 737.61481:6393,738.51471,738.51471
M739T691,738.5139306,691.4815,0.529990812,0.412269683,1.114972487,NS,0.522837815,0.15700811,0.3848186,neg,1.58258678,1.559017555,1.739226192,2.355285629,3.623111306,2.217808948,5.203853073,1.232040319,1.471217882,3.568767745,1.343842286,1.938188248,3.049962549,1.021602357,2.366561528,2.496561984,2.746709043,1.80979906,1.620733401,2.311819415,1.121290592,3.342958794,1.546041802,3.943176391,1.827161203,3.456190093,1.461411853,1.047185522,2.465016472,3.534564691,2.687982073,2.599745078,1.476613744,1.873736817,2.210443179,2.261456257,1.563234899,1.214791885,3.931547759,3.893365071,2.910310263,1.630820841,2.103777737,1.879223887,4.265343711,0.951288174,4.314316979,2.35622884,738.510238,738.5176231,Ns,PE 36:4|PE 16:0_20:4,S,738.51471,11.529,7408,[M-H]-,C41H74NO8P,PE,NQIMLWFRWGTTOZ-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,65.1,46.9,738.51471:7780966 739.51806:2738810 740.52142:702308,59.01273:20633 61.93803:4279 68.07524:2914 73.89113:3491 74.18275:3371 77.77431:3043 78.95797:32135 91.54121:3537 116.72348:3364 122.00033:3589 135.25305:4395 140.0114:26788 159.68745:3374 175.06512:3084 196.0383:12767 205.19667:4567 209.45708:3238 255.2343:156138 256.23773:29333 259.24533:13129 260.24881:4418 279.23328:4251 291.94943:3746 303.23483:116898 304.23782:23223 312.89935:4456 352.66315:4165 508.88019:3479 735.88757:4371,738.51471,738.51471
M741T707,740.5299273,706.774,0.547010489,0.250509812,0.834458985,NS,0.357314669,-0.261086954,0.601175259,neg,0.970020212,3.010482419,1.260891246,2.223966455,2.817468971,5.112359379,6.121492593,1.330866499,1.541342682,4.850984917,3.244335518,2.942940793,3.012771376,1.689252296,1.413989541,2.260827733,1.481002962,2.920827483,2.755088081,2.114963123,1.927141937,4.439640515,2.795047877,7.845565111,2.402311132,3.550197773,3.066184838,1.712698008,2.719137299,2.239501768,1.203361132,2.814120623,3.429783477,1.327710335,3.538365854,2.525013531,1.68056675,1.183359191,3.041743292,4.419956794,3.371530364,1.65665961,2.540160249,2.84664913,8.835247332,2.736313452,6.212701059,4.356870132,740.5262247,740.53363,Ns,PE 36:3|PE 18:1_18:2,S,740.53052,11.782,7436,[M-H]-,C41H76NO8P,PE,GKAFCSRKMWFPSJ-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,77.5,46.9,740.53052:2171079 741.53387:1185009 742.53723:311674,54.94222:2732 56.32102:3324 56.43279:2733 57.24292:3262 59.0125:4252 66.26276:3126 70.18326:3233 78.95803:81648 96.96844:4327 114.53793:3346 119.42503:3558 122.0001:10385 126.87034:3467 135.96619:3444 140.0114:69810 146.54939:3563 161.70561:3999 196.03859:38395 197.04285:3995 198.20358:3559 255.23579:5668 261.22351:7122 262.80786:4166 279.23471:874708 280.23804:157974 280.26987:5735 281.25049:413603 282.25397:71127 444.90973:4006 478.2998:6576 578.06317:4139 633.13275:4344,740.53052,740.53052
M741T719,740.5298092,719.109,0.586972121,0.203710009,0.825840355,NS,0.303597239,-0.276065177,0.690987631,neg,1.041669397,2.417008221,1.451531301,3.943346656,4.370040324,4.302582491,6.493065205,1.194886182,1.280208883,3.312120003,2.131420945,2.417137447,2.148549755,1.352668844,1.82306018,2.362665237,2.138541858,2.869157464,2.46732521,3.770418423,1.307032381,3.204783059,2.848949645,7.33379399,2.335575871,4.09089738,2.297691533,2.4922114,2.477993315,4.230877053,2.435639949,2.920425941,2.648922294,1.229003373,2.678915716,2.468746896,1.460054952,1.354132224,4.666328084,2.933946156,2.49054496,1.652325565,2.248294487,2.166570088,7.213629926,2.127596559,5.77766319,3.615692496,740.5261065,740.5335118,Ns,PE 36:3|PE 16:0_20:3,S,740.53021,11.976,7435,[M-H]-,C41H76NO8P,PE,IQLKOURRKVPATH-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,45.2,46.5,740.53021:508069 741.53356:293752 742.53692:54319,54.63042:3392 56.88593:2907 59.01278:7923 65.91245:2847 78.95805:23761 91.73009:3462 121.04496:3336 140.01126:21158 196.03836:10189 255.23444:72373 256.23755:12199 277.21896:40381 278.22241:9729 279.23541:30378 280.23993:8429 281.25046:16115 283.26611:26525 284.26736:6052 305.25098:118639 306.25388:31699 356.19073:4581 418.91711:4516 626.23865:3543 630.87787:4085,740.53021,740.53021
M743T691,742.5424893,691.1475,1.242383234,0.002349766,0.791879009,NS,0.008656798,-0.336648077,2.628975457,neg,3.271386802,3.999790131,2.611473148,3.187089384,4.075113141,3.683361574,6.0191589,3.090517197,2.22290595,3.971585123,4.083484229,3.177469698,3.834986141,4.152381815,2.620554382,2.123151819,3.241317032,3.569980589,3.630949919,2.643711436,2.91718601,3.922211805,3.130511889,5.42147724,2.917454987,2.732045103,3.870525014,1.573584188,3.307112208,2.560574271,2.312930111,4.651952719,3.236289915,2.583450763,4.18743633,3.834145915,3.572451344,2.498319801,3.59414925,3.442405346,3.162045768,2.407468171,2.554246064,3.690122014,3.298244036,3.073370637,2.511364721,4.171616929,742.5387766,742.546202,Ns,CL 74:3|CL 16:0_24:0_16:1_18:2,S,742.54224,11.518,7458,[M-2H]2-,C83H156O17P2,CL,SMWMTPQMORBHGO-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCC)CCCCCCCC=CCC=CCCCCC,53.5,28.6,742.54224:1903418 743.54559:1137284 744.54895:216434,53.07949:2975 58.58014:2824 59.01266:6027 61.51469:3008 78.95799:39448 152.99507:5879 168.04272:27518 224.07045:16369 253.21933:4515 255.23434:193805 256.2377:36508 279.23462:409163 280.23819:85914 281.25018:16359 296.88086:3769 330.84351:3702 457.67221:3921 480.30905:4238 565.6687:4214,742.54224,742.54224
M743T763,742.5456237,763.0765,0.766513714,0.056130904,0.776882973,NS,0.109601281,-0.364230802,1.250797966,neg,1.031770953,3.222965706,1.725205668,3.210062671,3.324406923,3.321663227,6.378030129,1.379278026,1.476717193,4.270333309,2.475557845,3.293315911,2.947220378,1.336852435,1.889898022,2.174190479,1.869795291,2.576075535,3.190125781,3.163192507,1.480282657,4.041986418,2.32284625,6.106816564,2.081611873,2.627769774,2.38007677,2.159749395,2.633351764,2.457165017,2.042972565,2.581666911,3.119282141,1.502973019,3.011593803,1.704714086,2.514910141,1.595282897,3.174623775,3.698645847,3.32227924,1.456308006,2.21412815,2.987198891,6.13784585,1.815983184,3.011011385,5.153230251,742.541911,742.5493365,Ns,PE 36:2|PE 18:0_18:2,S,742.54584,12.722,7459,[M-H]-,C41H78NO8P,PE,YDTWOEYVDRKKCR-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,75.2,46.2,742.54565:11207678 743.549:5756806 744.55236:1386687,56.24428:13836 59.01273:35823 59.36429:13679 62.96331:16428 68.75239:13942 70.30893:14066 74.36272:16925 78.95802:509682 83.90035:19124 96.96899:24416 122.00048:67352 140.01138:467435 152.9951:26795 196.03825:227795 214.04939:18975 215.2905:16799 261.22327:38700 279.23471:5567276 280.23819:1076416 281.24542:54786 283.26611:2235173 284.26941:445252 284.3006:18139 298.16061:15213 480.31412:34782 646.08972:17741 656.3028:17041 737.46234:18768,742.54584,742.54584
M745T741,744.5581683,740.984,0.417359058,0.884559614,0.983041541,NS,0.919437543,-0.024675712,0.053272893,neg,2.766146263,3.295999266,3.08170758,4.88703538,3.474320293,4.039314442,6.765509477,2.368134671,2.050212961,2.566652451,3.067012877,2.291637205,3.552580681,3.756436303,2.853371663,2.289241827,2.236409367,2.149549424,2.667550939,5.1821165,2.446474806,2.276548502,1.507784183,4.888915942,2.900693483,2.5129007,2.730660398,1.356088775,4.40610191,4.493879681,3.072282722,2.059855612,1.70356401,2.730174418,4.463071344,4.216192061,2.875734294,2.095606152,5.016256959,3.739205969,2.966692158,2.42508737,3.329499063,4.582144398,3.979122485,1.667279566,4.632290411,1.798331111,744.5544455,744.5618911,Ns,CL 74:1|CL 16:0_16:0_24:0_18:1,S,744.55933,12.344,7484,[M-2H]2-,C83H160O17P2,CL,BCBOBOQOPAWMCS-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)CCCCCCCC=CCCCCCCCC,71.6,30.7,744.55902:743668 745.56237:572600 746.56573:115467,53.76819:2667 60.42232:2757 78.95811:42251 87.27882:3871 110.2544:3556 114.5845:3172 149.93655:3480 152.77809:3708 152.99524:5265 168.04314:30423 214.15968:4079 224.07021:15982 255.23441:217227 256.23849:33984 281.25043:520651 282.25394:98046 735.94958:4550,744.55933,744.55933
M745T806,744.5617893,806.141,0.753535875,0.051202385,0.764326798,NS,0.102100249,-0.387738482,1.290709808,neg,0.868397856,4.435867493,1.923450587,4.214521214,2.686222059,4.304559945,6.297872932,1.493783382,1.279616637,3.336837554,2.449305716,4.170162823,2.002439973,1.271660311,2.28773111,5.778464386,1.831808858,1.44338983,3.659820261,4.090101808,1.40690129,3.894378965,1.755932859,5.957220826,2.593215207,2.311158454,2.183342094,1.733089277,2.401463849,3.011029191,2.423674697,2.741410776,2.830336932,1.454874486,2.277050576,2.325971227,1.874844209,1.899088593,5.300567519,3.237098789,2.486895368,1.817265612,1.867184503,2.231647287,4.067224176,1.993838616,2.90503608,4.299085259,744.5580665,744.5655121,Ns,PE 36:1|PE 18:0_18:1,S,744.56232,13.446,7485,[M-H]-,C41H80NO8P,PE,JQKOHRZNEOQNJE-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,70,46.1,744.56232:2451985 745.56567:1378187 746.56903:364019,52.02711:3016 59.01258:3944 59.74889:3344 71.03086:3153 73.66649:2882 78.95804:43088 96.96896:3399 99.03658:3368 108.41018:3354 122.00061:6038 129.67465:3928 140.01137:35498 168.04315:4650 196.02206:3697 196.03848:15624 241.15401:3884 255.23424:12097 279.23584:13916 280.23907:6464 281.25046:437757 282.25385:67147 283.26614:157245 284.26935:29232 309.28223:31126 386.47061:4156 398.55182:3511 432.64792:3725 480.31021:6087 543.68048:3920,744.56232,744.56232
M747T671,746.5194933,671.325,0.467162131,0.682409948,0.932993011,NS,0.763816914,-0.10006182,0.165954651,neg,3.006638112,4.242736473,1.483494866,0.661243442,1.68066808,1.56015656,4.203690453,1.719096754,2.481651486,1.591373789,2.18687954,1.208420529,3.314023598,3.528850149,1.82592759,1.432386833,2.35298791,0.964784248,2.802840768,0.938893118,0.82832362,3.330567939,2.211646085,2.323513336,6.532225413,3.640231609,3.517940629,1.371157018,2.493363514,6.756250338,1.346558307,3.948476215,0.801003781,2.719719223,1.900957619,3.29658776,1.225652526,2.957931977,4.583594899,2.155084857,2.553258594,1.743985058,0.832075612,2.324771039,1.358016601,1.368361278,0.803632757,5.453744063,746.5157607,746.5232259,Ns,PE O-38:7|PE O-18:3_20:4,S,746.52081,11.189,7510,[M-H]-,C43H74NO7P,EtherPE,QXCZJYCCKCJFSD-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,18.2,49,746.52039:1504519 747.52374:897998 748.5271:193072,53.43944:2984 59.01001:5921 59.01274:73636 78.95802:1206336 83.04919:7692 96.72134:3558 96.96841:22793 97.89043:3359 110.21023:4107 122.00034:7993 122.98426:13009 140.01143:61573 163.01628:9516 168.04312:766990 169.04724:8882 190.46846:3750 196.03859:49543 205.19688:7533 220.71083:4061 231.21165:6764 237.22408:5399 259.24411:34942 260.24817:6122 263.24219:5378 283.24451:6647 303.23499:268650 304.23859:54522 327.23431:7414 346.58255:4280 399.23541:8299 434.62738:4514 436.28442:5070 442.27689:18148 449.31714:8604 460.28668:39230 461.29303:10774 687.55005:258645 688.5517:43163 737.5011:4947,746.52081,746.52081
M747T699,746.5194612,698.732,1.598740194,7.17E-06,0.582018557,NS,6.79E-05,-0.780862943,5.144532016,neg,2.698956047,4.085406793,1.435927244,2.16973586,2.885648461,1.53739244,5.196611453,1.517819593,1.630145576,1.533946279,3.376536363,3.466528883,2.209168841,4.277975212,1.90976516,0.953765261,3.147549851,1.184239549,3.619667322,2.186806216,1.034830004,3.817524257,2.89552772,4.511016024,2.710290273,3.788532371,4.429675001,0.939888008,1.700178748,3.107026663,1.581879486,3.838361414,2.085920375,2.602547025,4.292610731,3.401940533,1.832180725,2.207738588,3.568432274,1.932172877,2.209867033,1.503160565,0.933694635,2.357626996,2.096487586,3.183470454,0.775920332,3.698827486,746.5157286,746.5231938,Down,PE O-38:7|PE O-16:1_22:6,S,746.51978,11.65,7509,[M-H]-,C43H74NO7P,EtherPE,WVGALBKSWOUIEZ-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,28.4,46.7,746.51978:11407505 747.52313:5401932 748.52649:1456114,59.01268:138528 78.95805:365753 87.45644:8103 96.04729:8367 102.6284:6838 107.0855:12364 113.35144:7883 121.10166:18567 122.00068:21161 135.1176:10899 137.00043:8741 140.00093:13847 140.01141:175122 142.22972:9111 149.13333:13802 152.99522:13376 163.01628:38432 175.14857:10502 177.16534:8260 178.02696:13153 179.03471:10990 196.03842:145254 205.92502:7933 208.71744:7854 214.18233:8751 227.20238:18569 229.19803:40932 230.20055:9346 239.23927:106122 240.24159:15321 283.24478:150846 284.24927:27399 327.23523:190586 328.23935:32654 375.23306:16302 418.27545:69410 419.27673:14047 436.28644:154703 436.34555:8324 437.29135:33794 478.82812:8767 737.59039:9616,746.51978,746.51978
M749T722,748.5345911,721.579,0.638963822,0.27263832,0.859965085,NS,0.381383362,-0.217650008,0.564413102,neg,2.72146444,4.374763473,2.681770514,0.790567775,2.557589912,2.260852328,3.342476727,2.452139318,0.990107599,1.619523179,2.5861507,1.774288277,2.733891709,3.347413622,2.343251673,1.124535275,2.988670879,1.755277253,2.979758038,0.665600995,1.33983468,3.629831285,2.63185067,4.431990486,2.634295627,4.146946933,5.652427993,0.595756158,1.58028066,3.754921774,1.336160605,3.114721709,1.464254443,3.35514103,2.220630217,3.302550554,1.744384288,2.838808804,4.544240717,1.367923711,3.122892625,1.671094343,1.585750298,3.010759094,3.038653035,1.855896154,1.46769693,3.676462157,748.5308484,748.5383338,Ns,PE O-38:6|PE O-18:2_20:4,S,748.53479,12.031,7531,[M-H]-,C43H76NO7P,EtherPE,UIOPUEZHKHUYIV-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,53.7,49.1,748.53479:18893944 749.53814:9080115 750.5415:2385082,53.01501:18148 53.19627:25884 59.0127:460422 60.89477:23215 71.01257:39351 78.95803:1353804 82.6434:22275 83.04892:53133 87.43967:23506 122.00038:72987 127.35742:22436 130.39856:23018 134.98483:27672 136.99992:28136 140.01143:561633 152.99548:42634 156.42078:22122 163.01611:95540 177.09218:30779 177.16547:28723 179.0354:69611 191.10843:32722 196.03842:449688 205.19722:134567 215.96838:24877 231.21193:49070 231.5966:27084 259.24423:387776 260.24805:66543 265.25531:195466 285.22388:61527 301.21994:38613 303.23502:3320944 304.23865:698824 305.2388:40404 312.11951:26737 329.25189:123467 330.25717:27201 367.18259:23160 401.24753:43991 444.29099:238781 445.29343:41442 462.30185:520701 463.30719:131585,748.53479,748.53479
M751T731,750.5506065,731.138,0.929782129,0.023842354,0.670336181,NS,0.05568688,-0.577043291,1.622650867,neg,3.441439279,4.797368324,3.031297483,0.965064531,6.181263545,2.920765069,2.847889384,2.396328584,0.732964018,1.656957778,2.272538383,2.432209352,1.983276567,4.008690872,1.95599387,0.837680684,1.865925966,2.007040361,3.416236502,0.969093177,1.092449361,5.150196413,3.318885196,2.936042038,4.411335158,3.768985223,4.673053257,0.781285598,1.285683983,2.924250926,1.236824227,8.537998648,2.655297117,2.799028752,2.876835579,2.562953438,1.404268292,2.424112777,3.328549184,0.925698915,3.066413557,1.321922315,1.610229068,2.51373568,5.830728384,2.516843784,1.299198315,4.374189233,750.5468538,750.5543593,Ns,PE O-38:5|PE O-18:1_20:4,D,750.55139,12.192,7559,[M-H]-,C43H78NO7P,EtherPE,ZTZQZGHJLWFLFQ-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,39.9,49.5,750.55139:1829968 751.55474:1050422 752.5581:275902,52.36936:3033 52.93005:3138 57.1454:2697 59.00996:5148 59.01271:52511 61.99735:2952 62.01563:3190 78.95801:98713 81.02433:3431 83.04922:6185 86.0615:3563 91.86844:4493 122.00064:4059 140.0114:48922 163.01569:4939 163.07683:3672 196.03821:14995 205.19691:6146 239.75215:3926 257.22836:10756 259.24484:22210 260.24588:3893 267.27078:5833 276.63968:4183 285.22543:4106 301.21832:34910 302.2225:7209 303.23508:162806 304.23911:30681 305.24704:4055 329.25217:31881 330.25528:6574 403.2659:6776 438.30331:8193 439.3071:4108 446.30777:15699 447.30991:5728 464.31741:32421 465.32001:6987 613.07074:3895,750.55139,750.55139
M751T761,750.5507524,760.983,0.546876457,0.607272425,1.056430131,NS,0.700030117,0.079197355,0.216616439,neg,4.180411482,5.580628947,3.19035197,1.274820906,2.904280954,3.257680534,3.777523504,2.98942754,1.58747176,2.630941338,2.683291846,2.824462785,2.565434777,2.910559401,2.643880434,1.454461665,3.26692044,2.017696348,3.690749941,0.885895622,2.680123831,2.418145897,3.269507169,3.695530852,3.284020781,4.252307204,3.328840384,0.589991991,3.427197256,5.053432055,2.677690393,3.933675896,1.632034677,4.055902441,2.89220504,3.899039035,2.879453696,3.773592382,4.426114782,2.631934902,3.373906349,2.514565351,1.27523174,4.534643058,3.136942431,2.475260819,2.157489186,3.426251629,750.5469997,750.5545052,Ns,PE O-38:5|PE O-16:1_22:4,S,750.55115,12.694,7558,[M-H]-,C43H78NO7P,EtherPE,IABMLWQTSKBCJV-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCC=CCC=CCC=CCC=CCC,30.1,49.8,750.55115:1516394 751.5545:880170 752.55786:250115,53.33518:2801 54.30422:3009 55.23902:2737 58.52404:2871 59.01269:30832 62.754:2797 63.2165:2993 78.95804:45252 88.97886:4285 91.63435:3095 113.59852:4043 139.28857:3545 140.01173:21200 145.46957:2979 163.0166:5015 166.02693:3952 193.8555:3338 196.03848:14834 222.59038:3509 239.23819:6421 303.23489:25267 304.23859:10995 305.25043:70025 306.25467:12861 329.2507:7135 331.2666:80113 332.27097:19774 436.28641:10034 462.29956:3617 573.21899:4521 640.05536:3875,750.55115,750.55115
M751T777,750.5502381,777.05,0.920193127,0.037021444,0.761428564,NS,0.079082884,-0.393219404,1.43154664,neg,2.712941549,4.58846969,2.461653106,0.798692875,3.178816346,1.975565495,3.766027124,2.435178997,0.866470534,1.977135491,2.275732854,2.819009404,1.808417709,3.184012214,2.498463702,1.085160198,3.047850595,1.540718522,3.541882999,0.788345282,1.277077461,4.010843272,2.863588173,4.485701083,2.777770165,3.674500173,4.883296218,0.612810475,2.081501041,3.621795658,1.583717456,5.070065804,1.67904531,3.459798229,2.66601216,4.312101657,2.638982858,2.660982536,3.551397931,1.80861474,2.764203831,1.745701571,1.580547526,3.208583439,3.639282962,2.890067883,1.572575521,3.552261238,750.5464853,750.5539908,Ns,PE O-38:5|PE O-18:1_20:4,D,750.55066,12.96,7557,[M-H]-,C43H78NO7P,EtherPE,ZTZQZGHJLWFLFQ-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,54.6,49.1,750.55066:35723024 751.55401:20133358 752.55737:5309753,57.00227:42704 57.47782:42533 58.9438:42861 59.0127:809472 78.95805:2362164 83.0494:64346 83.32296:52339 87.4576:63222 106.71466:50442 122.00085:108610 129.96278:50534 136.99994:62123 140.01147:1140168 152.99556:87334 153.631:54538 163.01666:191570 166.02769:66809 171.93227:45937 177.09196:55554 179.03467:127800 196.03854:816170 197.04237:70352 205.19681:231529 231.21254:126195 259.24448:752484 260.24753:114091 267.2713:716914 268.27518:92198 285.22379:115172 303.23505:6447786 304.23849:1041931 354.87115:60308 359.48389:56599 371.24081:62451 404.26733:67475 446.30795:367424 447.3092:112915 464.3176:1013084 465.31995:310302 487.64124:67018 583.7099:61001,750.55066,750.55066
M753T787,752.5665729,787.1885,1.104931124,0.004665634,0.496204354,Down,0.015144417,-1.010993701,2.331089355,neg,2.80453375,5.376822373,2.102766648,1.14117132,8.81329571,1.950268197,1.999697491,2.156360934,0.57621056,1.376747525,2.271786756,2.971948101,1.362118489,4.181813968,1.804902635,0.682589802,1.36317721,1.275417447,3.186629407,1.088564383,0.927820632,5.673878103,4.077470058,3.629120049,3.33155196,3.257829253,6.318217332,0.902490378,1.424951858,2.522340347,1.127490692,12.08623785,3.831015638,2.532151988,4.661503857,2.287045793,1.85868153,1.658414957,2.476818374,1.188091174,2.120854516,1.090632611,1.36843995,1.816204242,9.728545341,3.803731843,1.353742463,4.093990796,752.56281,752.5703357,Down,PE O-38:4|PE O-18:0_20:4,S,752.56714,13.128,7572,[M-H]-,C43H80NO7P,EtherPE,RXEVLILBESBJQS-UHFFFAOYSA-N,O=C(OC(COCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,42.5,49.5,752.56696:2221184 753.57031:1420040 754.57367:349721,59.01269:45702 78.95801:83163 82.34811:3851 93.7871:3354 120.16595:3458 122.00055:5051 131.02802:3046 140.01144:44238 163.28142:3478 164.11227:3391 175.62289:3511 196.03818:9269 205.1972:7331 211.19646:3632 259.24442:25811 260.24725:6207 261.24731:3482 279.23438:97566 280.2373:15902 281.2496:12143 297.9541:4526 303.23492:204179 304.23914:49663 305.24545:4726 307.26608:7835 308.26669:3841 331.14188:3595 353.10818:2995 405.28223:10244 448.32205:14791 449.32498:3933 466.33368:45139 467.33853:12491,752.56714,752.56714
M753T801,752.5664055,800.59,1.006735794,0.01366121,0.664362656,NS,0.035524926,-0.589957113,1.864510834,neg,1.764155422,6.357157729,1.551484828,1.310504262,3.050797154,2.916956018,6.726252877,1.857036357,0.714338534,1.877384577,2.664300458,1.595164479,1.452884416,2.985377138,1.210924845,0.920674425,2.31448708,0.694812031,2.577928803,1.469902128,1.215780528,2.057952903,3.469319493,4.029390785,2.033238321,4.057207431,4.671128849,3.71573679,2.50626795,6.187642134,0.993800502,5.943210697,1.500629228,2.651711432,2.345832311,4.493250156,3.206770865,2.251121083,4.14385302,2.085533894,1.950755359,1.902929868,1.016122141,2.921593541,3.771181231,2.172922789,2.208092196,3.929386936,752.5626427,752.5701684,Down,PE O-38:4|PE O-18:1_20:3,S,752.5672,13.348,7573,[M-H]-,C43H80NO7P,EtherPE,ADYILQKXUHGAJF-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCC=CCC=CCC=CCC,62.4,46.8,752.56665:1063031 753.57:544958 754.57336:138944,53.24596:3449 56.91121:2681 58.57201:2760 58.94166:2674 59.01271:41855 60.63401:2938 61.98697:4211 62.38725:3184 65.00016:2960 69.43563:3038 70.49345:3309 78.95803:96205 78.97977:3363 82.8682:3122 97.06484:3480 122.00047:5845 131.28511:3979 133.62186:3396 138.10115:3488 140.01141:44403 163.01772:7515 177.86977:3523 179.03644:4901 186.65581:4325 196.03819:32109 256.23187:3286 267.27133:26152 268.27417:5511 277.22061:6123 279.23514:4142 287.24106:5224 303.23563:20782 304.23911:11288 305.2507:564212 306.25412:110935 333.28235:5346 446.30847:18670 447.31082:5036 464.31805:38731 465.3222:10459 665.31183:4088 725.30627:3822,752.5672,752.5672
M754T319,753.5300789,318.772,0.860911954,0.019645674,1.140676187,NS,0.047585404,0.1898893,1.706733064,neg,3.770350719,2.453176796,3.388086447,3.801220624,2.720196099,2.207468439,2.721553535,3.915079124,3.062456776,4.330905876,3.554412324,3.323041952,3.520602765,2.808636818,2.617272551,3.50432116,3.822722149,4.08397786,3.277235594,3.548227474,4.164081323,2.65041665,2.673313347,3.76739291,3.473890221,4.236198189,1.956611113,4.339488464,3.690532755,4.103776294,3.222999018,3.358986562,4.00342018,4.502309535,3.331640732,4.409734137,4.417627347,3.5414895,2.359750885,4.191637124,4.149128326,4.192931791,4.958065736,3.870690865,3.937517146,3.167688893,2.753041446,3.250941193,753.5263112,753.5338465,Ns,CL 76:6|CL 18:0_18:0_18:0_22:6,S,753.53082,5.328,7582,[M-2H]2-,C85H154O17P2,CL,OLNAPSYMZKIVGB-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)CCC=CCC=CCC=CCC=CCC=CCC=CCC,69.4,21.3,753.53082:980352 754.53417:496358 755.53753:79639,59.01273:124994 61.98722:21769 65.8005:3411 91.8628:3724 117.7003:2951 141.01662:31363 152.87769:3860 153.26729:3568 196.86024:3847 208.33215:3486 265.25986:3475 283.26608:746696 284.26956:136226 285.27335:3789 338.7294:4033 365.26987:72240 366.27277:22656 589.52142:18247 590.52734:7926 620.81573:3741,753.53082,753.53082
M755T838,754.5819934,837.9015,0.983825071,0.014155686,0.750048923,NS,0.036558114,-0.414943394,1.849069089,neg,2.24383377,4.087939822,1.56008636,2.279216917,4.119204201,3.610902386,3.968977305,2.10542246,0.717550469,2.468105877,3.488349616,2.14217866,2.421242673,3.216740575,1.368083054,0.757842096,3.250902784,1.458901186,3.455207713,2.136273723,1.891387179,2.933821615,3.345686218,5.569909837,1.954323944,3.113725992,3.973915175,0.771258869,4.101789997,4.25488239,0.576672774,5.263651171,1.895563036,2.004175603,3.622069818,2.811912691,3.915955428,2.235237457,3.662182034,3.792708146,3.15328349,1.740963065,1.622706079,3.32134022,2.965349261,3.725116054,2.997478297,3.157308317,754.5782205,754.5857663,Ns,PE O-38:3|PE O-20:1_18:2,S,754.58276,13.978,7588,[M-H]-,C43H82NO7P,EtherPE,RNRKBPIUFPHDJL-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,58.4,43.8,754.58276:1195299 755.58611:771826 756.58947:223896,59.01268:31388 61.98719:5469 62.01954:2751 67.0923:2852 78.95796:50007 82.99054:3325 87.94106:3190 91.86653:6320 102.61677:3253 140.01111:30299 149.27457:3189 178.0278:5020 179.03549:4214 185.00197:3535 196.03839:16948 238.29276:3440 273.34518:3616 279.23474:417354 280.23822:75265 281.24875:13438 295.30328:9764 307.26566:22571 309.28577:4593 312.4794:3463 437.03439:3455 474.33755:11165 492.35074:17887 493.35684:4762 600.54816:3828 737.49341:4381,754.58276,754.58276
M757T626,756.5696655,626.393,0.508754191,0.734879466,0.95929314,NS,0.804857593,-0.059956354,0.133783887,neg,1.893092864,3.339301585,2.50740889,1.31609838,1.74857934,2.390379973,2.824196874,1.719467189,1.554542196,1.884803085,1.639787038,0.935430098,2.593997116,1.757015664,2.172121312,0.793273434,1.779830146,1.957658895,0.832113128,1.45086549,1.440794983,2.048317379,1.536508909,3.790852449,1.932047138,2.408832568,2.824151917,0.221071183,2.020597953,2.087254146,1.082995368,2.882612065,1.661983424,1.766151515,3.845152235,3.016266798,2.582467168,1.450004648,2.869923997,1.777806519,2.151231784,2.829701059,1.656630864,2.131309965,1.730797978,1.29109042,1.608372984,1.822724559,756.5658827,756.5734484,Ns,HexCer 34:2;O2|HexCer 18:2;O2/16:0,S,756.57037,10.427,7609,[M+CH3COO]-,C40H75NO8,HexCer_NS,VCLOTRNDBUPTQD-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCC,43.3,32.6,756.57037:365172 757.57372:241410 758.57708:70107,53.15704:2727 56.37738:3018 57.03333:3645 59.01272:116728 61.98709:2922 71.01279:63880 72.99216:6164 73.02852:6134 85.02859:9469 89.02349:70338 95.01298:4156 101.02361:47061 113.02375:26916 119.03436:23318 149.35582:3559 159.0295:3978 174.79318:3509 197.83586:3423 235.20856:9034 237.22353:12002 250.1288:3332 254.25066:8266 255.23442:8346 261.22504:6596 280.26694:41939 281.26999:6865 296.02344:4324 296.26163:7251 472.82892:3658 534.49286:23171 535.49622:8190,756.57037,756.57037
M757T875,756.5982097,874.912,0.495940268,0.911724304,1.011612477,NS,0.939306369,0.016656736,0.040136468,neg,2.152047124,3.99872188,2.150314646,2.316642066,3.462749014,4.027771381,3.841331732,2.00040533,0.995737072,2.892353421,3.057355174,1.974973695,2.693968637,3.046826994,2.134859705,2.142614798,4.253146905,1.528211847,3.703343237,2.415046033,2.087666629,3.055440737,2.452219315,4.500030968,2.665121618,3.866773194,3.590093733,0.789120269,4.740221434,6.542917241,1.430113444,4.736919806,1.970412236,2.779389406,2.332588415,3.118224727,3.525074025,3.589737617,5.19501156,4.067841131,3.102952529,2.346815735,2.179944294,3.686500204,3.083523914,3.154153513,3.328341297,2.634858131,756.5944267,756.6019927,Ns,PE O-38:2|PE O-20:1_18:1,S,756.59851,14.578,7610,[M-H]-,C43H84NO7P,EtherPE,JAFJRYZSUHZYCC-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,48.9,42.6,756.59869:357259 757.60204:219958 758.6054:64714,59.01271:14993 61.98728:13259 69.93227:3328 78.95813:32495 116.13743:3311 121.02895:5330 140.01143:13127 166.18922:3674 196.03824:6919 217.00348:6785 228.75706:4058 255.23466:8839 281.25043:263549 282.25372:48689 283.26456:4121 295.30212:8435 309.28226:41518 310.28503:5746 413.23163:3728 450.0701:4524 474.33939:6221 492.35223:8046 523.24872:3538 737.69501:4972,756.59851,756.59851
M759T691,758.5848219,691.479,0.811304849,0.042924879,1.181159971,NS,0.088872093,0.240204371,1.367290921,neg,3.80698938,5.660729685,6.847042592,3.761564862,3.920517402,4.923053814,4.625373677,6.043682527,4.694577826,4.147383436,5.272142195,3.110655453,5.85164405,3.903233634,5.562726434,3.460164977,4.067652625,4.552301539,2.489706459,3.777015971,6.568715294,4.474600108,3.247560082,4.610903725,5.54999656,4.76420334,4.914674449,2.048385068,5.726886512,5.761880356,4.722934902,6.475698757,6.230718887,6.301753349,6.764099064,7.825758414,7.748650262,4.83262688,6.94072422,4.479435653,7.565778549,7.397904717,6.336871669,5.425105786,4.897527471,5.516796703,4.0629545,3.918820256,758.5810289,758.5886148,Ns,HexCer 34:1;O2|HexCer 18:1;O2/16:0,S,758.58563,11.525,7629,[M+CH3COO]-,C40H77NO8,HexCer_NS,VJLLLMIZEJJZTE-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCC,43.3,33.1,758.58557:1180227 759.58892:696028 760.59228:238456,54.88461:2975 55.01781:5545 58.11753:2870 59.0127:199046 60.01606:3278 69.28545:3352 71.01275:97497 72.99221:7720 73.02827:4621 73.56956:3009 78.95803:7424 83.01271:3693 85.02866:17737 89.02346:86283 95.01304:4620 101.02356:68512 102.02719:3499 112.16981:3672 113.0236:34725 119.03429:32427 120.67422:3972 122.44748:3587 132.35719:3469 237.22397:37679 238.22859:5613 254.25052:10829 255.23425:13522 263.23972:5423 277.2901:3717 279.23376:8430 280.23669:6814 280.26578:50711 281.27155:6112 296.26163:10378 363.69614:3544 488.48599:6900 536.50818:33046 537.51208:11078 573.0036:4645,758.58563,758.58563
M761T729,760.535274,729.307,1.258649227,0.00057005,0.603235897,NS,0.002731294,-0.729205813,3.244086791,neg,3.697694615,4.680688229,1.144479843,1.935519115,2.138022248,1.480279841,4.619737604,1.961712369,1.81060802,1.183457651,5.941412385,4.034976556,2.437208714,5.365555118,3.002038768,0.911800936,5.498626538,1.117583693,4.07615905,1.930465147,1.213169457,4.662907684,1.469166694,4.842897373,3.623086934,4.584014835,5.252906759,1.005415533,1.413142386,2.671122287,1.399132446,3.721680268,3.727780434,2.769771689,3.031875883,2.79766314,1.382382705,2.401725419,3.79595648,3.074644974,2.194828168,1.821958782,0.739018545,1.918759619,1.666682161,3.912693884,0.778282437,3.902755337,760.5314713,760.5390767,Down,PE O-39:7|PE O-17:1_22:6,S,760.53577,12.164,7656,[M-H]-,C44H76NO7P,EtherPE,ZSLBASAVMDNZHV-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,22.9,45.9,760.53577:495565 761.53912:318880 762.54248:127936,54.80757:2804 59.01271:26184 69.87031:3038 73.15392:3029 74.36854:2935 78.95803:127371 111.35349:4051 140.01132:20455 144.8548:4307 163.01669:4233 168.0432:53021 196.03888:16795 229.19658:5934 253.25513:15642 279.2348:16702 283.24423:23193 327.23544:27483 328.23898:5037 432.28946:5934 433.29587:4019 450.30151:24097 451.30569:4308 576.41956:3780 687.54932:10914 737.56781:4875,760.53577,760.53577
M764T698,763.603634,697.5615,0.300403615,0.707741281,0.977435587,NS,0.78379541,-0.032926463,0.150125472,neg,4.985920728,5.814162995,4.880019372,5.048065492,5.489004375,5.237778458,5.663884222,5.330553072,3.721772185,5.761411432,5.757545697,3.54806366,5.164069288,4.787245328,4.331511045,4.947078309,5.092625992,3.500236318,3.758901128,4.927002536,3.40290609,5.641597508,4.203364262,5.886332596,5.103146827,4.955700873,4.98948732,2.9599315,5.412079669,6.18783644,6.277402267,7.705164098,6.300700352,5.377098431,4.556792978,6.386182375,5.644726022,5.900303173,6.727176663,6.166394553,4.594084402,4.704560172,4.862140635,4.831344879,2.445168042,5.0920862,4.598599664,3.897989574,763.599816,763.607452,Ns,SM 34:0;O2|SM 18:0;O2/16:0,S,763.60431,11.629,7705,[M+CH3COO]-,C39H81N2O6P,SM,QHZIGNLCLJPLCU-UHFFFAOYSA-N,O=C(NC(COP(=O)([O-])OCC[N+](C)(C)C)C(O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCC,38.1,74.9,763.60413:3110815 764.60748:1713728 765.61084:451901,112.10052:6227 118.46867:5882 122.00061:25317 122.98444:53084 140.01129:144215 152.99594:11569 168.04309:1852454 168.16656:6620 169.04691:78439 170.04778:8645 196.03857:110541 205.19688:27744 212.1666:6674 214.04901:13909 231.21227:8565 255.23444:161552 256.23792:11176 259.24506:109817 260.24698:12268 281.25034:963785 282.254:68101 285.22559:14225 285.25955:12699 303.23489:895198 304.23828:97300 308.79221:6327 323.54968:6902 329.25076:101633 330.25525:9261 345.61285:6137 407.02658:7181 426.99783:6060 451.3382:11858 478.29861:42104 618.49792:11947 687.54999:60905 688.55225:78465 689.56567:1095846 690.56903:485774 690.69257:9952 691.57532:38578,763.60431,763.60431
M765T694,764.5296776,693.702,0.703082132,0.168811235,1.198647072,NS,0.26194014,0.261406936,0.772598653,neg,1.571290556,1.679401722,2.324663231,1.939902398,3.344979474,2.963519709,4.620303374,1.267926063,1.400316406,4.453140677,1.935704559,1.574452104,2.788791361,1.14512509,2.705306524,2.949001238,2.786762903,2.361015686,1.712110438,2.12714177,2.045680586,3.432491119,1.387585817,5.018334799,2.384183954,3.737936181,1.609603463,0.86814498,2.477593108,3.886386469,2.229062837,2.440104242,2.137162589,1.888940148,2.330121899,2.422855726,1.249759172,1.302532445,4.748744979,3.627740184,3.541035337,2.04747226,2.206620382,1.914032312,4.164560057,1.0638581,5.349062516,2.722092853,764.525855,764.5335003,Ns,PE 38:5|PE 16:0_22:5,S,764.53052,11.567,7709,[M-H]-,C43H76NO8P,PE,BXSFSSDQHFBPDQ-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC,33.6,46.1,764.53052:3638930 765.53387:1743213 766.53723:388872,59.0127:14662 75.14487:3087 78.958:78469 82.25465:3176 98.02118:3067 122.00044:3609 134.68044:3445 140.01122:17071 166.67097:3009 168.04327:29650 169.04538:3114 178.97762:3261 196.03854:15133 255.23444:85563 256.23779:12810 259.24411:6204 279.23483:24192 281.25043:58943 282.2547:11393 285.26102:4836 303.23532:35792 304.23764:12138 326.31091:3981 329.25107:48859 330.25409:14751 446.5127:3496 493.38489:3454 615.59467:4210 689.56036:6398,764.53052,764.53052
M765T715,764.5301658,714.8325,0.370652667,0.477356521,1.115087358,NS,0.584902118,0.157156739,0.321157141,neg,1.67246929,0.868127691,3.570627301,5.204008655,5.896144313,3.198210945,4.486546286,1.12235549,1.64952201,3.468737191,1.094020559,2.413987976,2.945090779,1.064211356,3.312300546,2.897552081,2.828013392,1.738822151,1.905573558,4.980940904,0.919642858,4.064933303,3.138159778,3.224102317,2.654590371,6.18585923,1.603566062,1.494697852,1.939484403,5.141872164,2.575273391,2.730514391,1.585148846,2.392137603,1.919886071,1.849414679,1.777922737,1.996595454,5.213849155,3.467062455,3.025958652,2.227226614,2.885966724,1.965519122,4.489200689,1.019855054,5.341349231,2.368870604,764.5263432,764.5339885,Ns,PE 38:5|PE 18:0_20:5,S,764.53088,11.921,7710,[M-H]-,C43H76NO8P,PE,MOJMRZJNAPRFBD-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,45.1,43.9,764.53088:1009283 765.53423:596113 766.53759:158782,59.01276:21693 61.98717:8203 62.58468:3166 66.22041:3861 78.95805:116233 96.96877:4932 104.41202:3580 110.58566:3323 122.00047:3390 131.25941:3755 140.01141:22954 152.64629:3450 156.75676:3720 168.04317:43367 196.03857:12715 228.67647:3806 255.23434:13887 257.22833:9059 283.26608:104767 284.27002:17916 301.21976:33139 302.22366:8284 680.43561:4269 688.55658:5990 689.56061:5665 713.24908:3855,764.53088,764.53088
M765T803,764.5659464,802.632,1.068455517,0.008852604,0.522839748,NS,0.025151955,-0.935559272,2.052928961,neg,3.478570635,12.5240322,1.252546691,1.319069277,2.797109586,1.533841104,3.384508113,1.42406481,1.14999949,1.017435091,3.051961614,7.072539068,2.181685644,4.262295416,2.607113275,1.28161292,3.902851422,0.775368545,7.794337818,1.177431022,0.737291267,2.770118403,1.970342451,6.750527533,6.345938754,3.209708914,8.09751126,1.376744813,1.909725898,4.696834247,1.099650584,4.795672463,1.993745238,3.190721642,2.514845273,3.230407111,1.106513478,2.493679072,5.478385904,1.405343248,1.537734935,1.527517689,1.040773493,2.111899878,1.446798027,3.423741248,1.156373162,3.165754954,764.5621235,764.5697692,Down,PE O-39:5|PE O-19:1_20:4,S,764.56708,13.383,7712,[M-H]-,C44H80NO7P,EtherPE,BJNFZENODOCJEW-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,48.8,48,764.56689:278001 765.57024:191047 766.5736:53585,59.0127:11192 71.66468:3170 71.78502:3260 78.15914:2906 78.95817:22605 83.12022:3456 109.89679:3716 122.00078:3703 140.01125:8931 141.94138:3884 149.27841:3474 149.29199:3268 172.80717:3980 196.03886:7120 223.13306:4354 259.2446:5181 281.28775:7997 303.23508:52400 304.2381:10414 315.97366:3325 397.3129:4665 478.33276:5859,764.56708,764.56708
M767T752,766.5454437,751.969,0.717073076,0.061126939,1.214541892,NS,0.116932702,0.280412252,1.213767349,neg,1.921168977,1.940446962,3.050638893,2.889717339,4.003120167,2.183423997,4.111662263,1.447193027,1.984434142,4.676227901,1.472743943,2.018134113,3.001907626,1.087495688,4.205095563,3.599998485,3.27513496,2.143749984,2.450949482,2.789028986,2.000875844,3.665764607,1.562835005,3.698979753,2.192944503,4.153921043,1.656107013,1.576377168,2.455712934,3.627231458,4.421011995,2.515143543,2.184866553,2.853641345,2.180112456,2.607010178,2.188525198,2.174611933,4.645793817,4.301010934,3.752257083,2.208244765,2.45070969,2.220943479,3.202571543,1.295353697,2.811706624,3.196003541,766.541611,766.5492764,Ns,PE 38:4|PE 18:0_20:4,S,766.54602,12.542,7731,[M-H]-,C43H78NO8P,PE,YEHAZLUVAZKVRO-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,73.5,50.4,766.54602:20319514 767.54937:11897051 768.55273:3067114,59.01:19581 59.0127:209602 62.72007:11935 69.58292:13648 72.1528:12802 73.2478:15661 73.45176:15531 74.99546:13801 77.1431:13871 78.95801:420907 83.04903:20389 87.46976:15773 95.90909:14257 96.96867:33954 102.17133:14922 115.84138:14075 122.00069:52673 140.00107:22731 140.0114:345458 177.09216:17781 196.03845:227163 205.19701:54675 231.21143:22698 259.24457:231565 260.24805:24733 283.26602:2116954 284.26968:393632 303.23502:1805645 304.23856:374059 344.05188:16657 350.19379:16520 447.95312:20931 462.30237:24650 480.31204:45638 597.47174:16817,766.54602,766.54602
M769T706,768.5577804,706.474,0.429850473,0.288408264,0.866542716,NS,0.398037515,-0.206657226,0.5399923,neg,2.965359122,3.411520875,2.165083752,4.226200319,4.652795243,3.366996576,4.333888241,2.096571801,0.786292069,2.714205641,2.37451845,1.991653195,1.679923341,1.738266747,1.027915185,2.575654631,2.997331179,4.854955355,2.157846359,3.275654564,1.370792855,2.032815239,5.580779268,3.574063761,2.134571419,3.322102048,1.368645396,3.045131843,1.805025933,4.587558935,2.422308188,4.184935465,2.713566288,0.85943932,1.234702822,2.413300007,1.432116608,0.97516673,4.876542041,4.457788812,2.191301219,1.406604283,0.58740437,4.189838919,4.064207626,1.918517351,3.095469661,2.303081546,768.5539376,768.5616232,Ns,CL 78:5|CL 16:0_24:0_18:2_20:3,S,768.55994,11.782,7752,[M-2H]2-,C87H160O17P2,CL,JGMWDYZWLPZDNY-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCC=CCC=CCC=CCC)CCCCCCCC=CCC=CCCCCC,56.1,30.3,768.55945:336034 769.5628:146111 770.56616:0,59.01267:11462 72.53407:3046 78.95801:32553 84.45606:3548 91.86208:3634 112.12906:4455 139.98848:3661 149.28889:4074 168.04242:17802 177.96143:3679 224.07066:7749 255.23447:126098 256.23795:17950 279.23373:6993 281.25067:5992 305.25089:179976 306.25412:36818 335.87277:3720 564.09766:3851 713.41272:3716 718.34552:4066 735.86963:3861,768.55994,768.55994
M769T776,768.5615193,775.6485,0.577493327,0.142244336,0.798812195,NS,0.22856535,-0.324071738,0.846965016,neg,1.30059704,2.88639276,1.722213865,6.363428036,4.690892557,3.792103012,5.79049733,1.107182287,1.557771097,3.44681029,2.315172887,1.751800222,1.86320076,1.571908359,2.764207563,1.915827353,2.304184444,2.974592712,3.248916557,6.30805062,1.15392393,2.402932821,2.835571318,3.845959388,2.198677694,4.228369831,1.819828553,3.065578009,1.530126231,5.574484997,2.531890102,3.08034294,2.233022674,1.243915332,2.816544176,2.851375927,1.341395299,1.387161735,5.939620843,2.777112273,2.598116116,1.466324236,1.420077822,2.536277691,6.958653162,1.499416984,3.379264193,3.910449349,768.5576764,768.5653621,Ns,PE 38:3|PE 18:0_20:3,S,768.56207,12.932,7753,[M-H]-,C43H80NO8P,PE,MSYFXMJDQLPRGO-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,63,46.7,768.56207:1312543 769.56542:752989 770.56878:180988,59.01269:8158 63.83027:2820 74.68547:3136 78.95792:46159 117.08604:2856 122.00085:6622 140.01134:46152 180.28133:3918 196.03813:19296 220.36014:3119 255.23415:4336 255.70821:3836 279.23489:7637 283.26608:202819 284.26932:31132 287.24146:4201 303.23581:8501 304.23724:7768 305.25067:335303 306.25415:68680 349.27692:75385 350.28021:15690 418.27222:4815 558.40314:4017,768.56207,768.56207
M771T649,770.5197565,649.35,1.386987233,0.000102725,0.585967388,NS,0.000653982,-0.771107721,3.988325885,neg,2.544362749,3.568271166,1.005302205,2.14369985,3.1534431,1.255239577,4.724628269,1.589985126,1.484898251,1.403434689,3.683846443,2.068921349,3.389592414,5.113754131,2.065633499,0.594981112,2.729413736,1.310728687,4.502681598,2.092978182,1.082905795,4.657527684,3.291416289,4.058439491,3.112375197,3.905196186,5.206642184,1.022139108,1.20906609,2.800641237,1.013666043,2.912945951,1.699159336,3.101549181,3.70839428,3.584237384,1.390980953,2.645702214,4.505431386,2.83222358,2.889124734,1.708614038,0.860290217,2.252849694,1.325933582,3.302280707,0.556252486,4.458180578,770.5159039,770.5236091,Down,PE O-40:9|PE O-18:3_22:6,S,770.52057,10.824,7774,[M-H]-,C45H74NO7P,EtherPE,PGMAUSGKQUIFJI-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,22.7,48.6,770.52057:327916 771.52392:187454 772.52728:53347,58.56086:3847 59.01269:9697 62.46029:2959 74.7985:3719 78.95813:34357 82.79588:3150 83.32378:2943 87.15365:3022 100.48631:3174 103.26691:3477 140.01146:14141 149.09912:3867 196.0387:8187 217.00407:16382 283.24466:14160 327.23465:12135 460.28564:6591 482.5477:3731 709.1806:3642 736.70367:5747,770.52057,770.52057
M771T752,770.5731964,752.254,1.211059527,0.001663682,0.745855456,NS,0.00654015,-0.423032026,2.77892972,neg,2.375272543,1.48212864,2.806862025,2.727771303,3.446809525,4.329015421,5.144330947,1.877762813,1.938231313,2.913484562,5.070166865,3.446081493,2.443247118,3.416303377,2.338956578,2.230584839,2.634081519,3.259276541,3.709993582,2.478561612,2.7129409,4.537418383,4.397467626,4.716779023,2.644488056,2.151527586,4.361240312,1.659471814,3.472173883,2.605462323,1.929379515,4.2715675,3.241222986,1.274203065,4.748374843,3.01112202,2.496117886,2.630512262,3.739383329,2.50654217,3.191888034,2.39632398,1.890253337,4.017167141,3.798150713,3.378565056,3.440529317,3.579743487,770.5693435,770.5770493,Ns,PE 38:2|PE 18:0_20:2,S,770.5733,12.542,7775,[M-H]-,C43H82NO8P,PE,WYDGEVICLIVPEG-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,21.6,40.8,770.5733:1321639 771.57665:717522 772.58001:125196,55.13556:3178 59.01277:6923 59.10219:2929 69.77592:3391 72.21887:3324 75.43217:3838 78.95803:33447 155.80798:3327 168.04305:20787 224.06995:13198 226.19627:3600 255.2354:11556 279.23471:285904 280.23767:57898 281.25122:19755 282.25415:4949 283.26617:128856 284.26968:36707 303.23346:8542 304.23788:9617 305.24329:4652 307.26587:29617 517.58441:3919 700.47083:4199,770.5733,770.5733
M773T702,772.5353769,702.047,1.167852274,0.002152451,0.692511308,NS,0.008057814,-0.530090465,2.667066808,neg,2.705114002,4.225769745,1.437078,1.830772898,2.811292668,1.70035772,3.869707714,1.633283833,1.677724677,1.438876859,3.519141316,2.663355367,3.060480766,4.782186686,2.478010954,1.504470516,3.231089853,1.485765391,3.307495237,1.795300803,1.216324286,4.402184329,2.739780336,4.713394344,3.099564139,4.355456355,5.175117435,0.853722885,1.695804543,3.112296386,1.393661636,3.623917674,2.148882918,3.07773957,3.799116896,2.941092331,1.832194511,2.910093547,4.445708627,2.576279094,2.75664319,1.962038496,1.272636936,2.389282628,2.062285382,2.709896105,0.891665913,3.483326138,772.5315142,772.5392396,Ns,PE O-40:8|PE O-18:2_22:6,S,772.53595,11.705,7797,[M-H]-,C45H76NO7P,EtherPE,UKPNUUDYLNCIOE-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,19.7,46.1,772.53595:5843588 773.5393:3132680 774.54266:887300,57.16555:4714 59.01271:138688 68.22639:4435 71.01254:9206 78.14598:5311 78.95803:322872 83.04939:7981 84.83326:5303 105.07027:5346 107.08601:10013 117.07014:7651 119.08617:5984 121.10153:16125 122.00047:24473 124.01588:6179 124.02496:4968 133.10181:11399 135.1174:14961 137.00026:23442 140.0114:156214 141.05005:4936 149.09674:11321 149.13351:8746 152.99541:6322 161.13326:7523 163.01642:25442 163.07613:6028 163.14915:6811 166.02777:8928 170.49399:6460 175.14832:7785 177.16504:12705 179.03499:15035 191.18068:8131 196.03856:131272 205.16043:188403 206.16347:6732 229.19716:41148 230.20207:8829 249.187:9555 254.87602:5959 255.21219:6680 265.255:55707 266.25977:11498 283.24496:171682 284.24838:39105 327.23547:178132 328.23804:38488 401.24704:11225 444.29175:68914 445.29578:14714 462.30255:147778 463.30542:37415 464.31509:5902 605.41766:7958 661.46655:17479 701.50061:23266 716.52399:15948 717.53168:102099 718.53357:15595 737.49158:6616,772.53595,772.53595
M773T796,772.5891728,796.3195,0.492217753,0.316670578,0.860696719,NS,0.427851968,-0.216423125,0.499392286,neg,1.989847577,6.118829211,3.819547789,4.808456894,3.861738427,4.637846297,5.68660615,1.711377163,2.424444011,1.2763779,3.779228311,2.674693755,2.745319706,3.353932945,4.908587114,1.801946062,1.730508986,4.29840346,1.35572726,3.834890506,1.24254985,2.290291225,4.033818096,3.659023552,1.892076231,1.408145822,1.942706871,1.052184163,3.770726003,7.302663026,2.024015492,2.646634353,3.290585934,1.176328875,2.653284853,3.344410477,1.282696128,2.136522387,3.526472659,2.360498673,1.744456833,0.08526852,4.624438343,1.876701035,4.708176463,0.812377456,6.218700136,4.133566503,772.5853098,772.5930357,Ns,CL 78:1|CL 18:0_18:0_24:0_18:1,S,772.58557,13.28,7799,[M-2H]2-,C87H168O17P2,CL,XCSVRBAJHBHMPN-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)CCCCCCCC=CCCCCCCCC,70.3,29.9,772.58557:347298 773.58892:79566 774.59228:54870,55.25335:2949 57.19736:2755 57.59842:2590 58.7344:3223 59.01279:6545 74.17906:3043 74.2593:3811 78.95799:34268 111.96088:3498 129.04567:3501 149.57838:3464 168.04338:13471 222.5632:4011 224.07057:7299 281.25043:221658 282.25381:40816 283.26617:88280 284.27014:14403 309.28302:5692 407.73529:3471 555.84918:3727 761.59698:4927,772.58557,772.58557
M774T663,773.5405029,662.535,1.170243111,0.002978293,0.671232227,NS,0.010509243,-0.575116111,2.52603253,neg,1.949579048,2.473506551,2.386650583,4.066859272,3.921027042,3.211336258,7.842065892,0.934801993,1.440560097,3.393282534,2.773972811,3.707350253,2.384217413,1.711020268,3.351595287,1.97060779,2.152392507,1.31055969,4.682908638,5.048298939,1.339973351,2.555798698,3.086548469,4.099201756,2.829591558,2.311193888,2.280481807,1.416192367,1.535142726,3.640707546,2.867652925,3.891411361,3.626184195,1.604556967,3.491568006,3.83261736,2.427286447,1.878217168,3.659695165,3.232036878,2.907204352,1.82200599,1.888577242,1.590104236,4.123098889,1.802034393,2.185922665,4.273880837,773.5366352,773.5443706,Ns,PG 36:2|PG 18:0_18:2,S,773.54089,11.036,7808,[M-H]-,C42H79O10P,PG,JPRWHUSRRGNLOV-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCCCCCC,59.3,45,773.54089:183057 774.54424:87425 775.5476:28310,54.05808:3089 57.77168:3225 59.01267:23219 62.21926:3107 63.6507:3587 64.26643:2893 78.95801:38117 85.12328:3586 86.08829:3339 87.2002:3804 94.49523:3063 152.98509:3552 152.99542:21526 168.04306:14100 171.00658:6080 175.07358:4284 248.18649:3753 251.20193:4488 279.23453:162393 280.23886:25580 283.26599:48425 284.26889:9045 290.05511:3600 310.84567:3514 387.10443:3865 438.30746:4330 438.37201:3723 462.30978:3735 482.2247:3532 508.98071:3670,773.54089,773.54089
M774T699,773.5942928,698.802,0.171060809,0.645236387,0.975511238,NS,0.732616287,-0.035769602,0.190281149,neg,6.947786873,4.778332511,3.528935252,5.110896802,5.71015288,4.574077302,3.994639149,5.225529748,3.973646356,3.520024111,4.263241282,4.804604941,5.129156959,3.904841521,4.144799718,4.539232966,4.035660833,3.951173248,3.771097153,4.633811723,4.178070873,3.168868945,5.980547444,4.670903344,3.767426392,4.451767138,2.986659713,4.075945391,3.892222059,4.805296694,3.627967134,4.695966209,4.320673446,5.272586522,4.564805575,5.670856845,3.309764288,4.988605849,5.543229734,4.494592299,3.510973252,4.174748351,4.029452802,3.858978087,3.690917211,3.407338256,3.909643975,4.13989262,773.5904248,773.5981607,Ns,CL 78:0|CL 18:0_18:0_18:0_24:0,S,773.59491,11.643,7811,[M-2H]2-,C87H170O17P2,CL,MJDDQVIRMDFTPY-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC,43,33,773.59491:2788667 774.59826:1908513 775.60162:675283,54.22519:2864 57.83621:3724 59.01269:29739 59.4516:3135 61.70959:3755 63.3636:3081 69.85116:3470 78.95805:78435 87.25356:4502 94.59654:3949 101.93744:3439 110.37891:3813 140.01125:16116 149.09688:10440 168.04315:24411 196.03831:14038 205.16042:208452 206.16447:22043 208.49963:4089 265.25552:6861 283.24469:15490 284.24829:4472 310.01529:3836 327.23438:13282 328.24045:4068 444.29022:5773 462.30249:13025 511.36203:4205 550.7923:3916 645.4292:5317 661.46802:20089 662.47064:10534 701.48425:19655 702.50378:15247 716.51947:6035 717.53113:80136 718.53442:38520 773.59442:453019,773.59491,773.59491
M775T758,774.5510154,758.4325,1.461577823,0.000121972,0.594095587,NS,0.000752043,-0.751233024,3.913741521,neg,2.705895264,4.019216191,1.271007876,1.683605762,3.24950872,1.412854198,4.026617475,1.728765304,1.298296764,1.383892953,3.373942283,3.566136704,1.950018477,4.303961197,2.033454268,1.234822022,3.007408686,1.271775451,3.706006771,1.695295329,1.05434782,3.837876437,2.831364487,5.518359249,2.726306141,3.79507099,6.262068195,0.738261235,1.920497175,2.805972023,1.471537168,4.743728835,2.333668044,3.019813632,3.753099039,3.503849675,2.477232693,2.441050854,3.560200733,2.625384694,2.459098068,1.868090252,1.141973343,2.150964624,2.498817221,3.497552288,0.906806291,3.355867042,774.5471426,774.5548881,Down,PE O-40:7|PE O-18:1_22:6,S,774.55084,12.645,7822,[M-H]-,C45H78NO7P,EtherPE,FIJFPUAJUDAZEY-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,20.5,42.6,774.55084:11217526 775.55419:7232995 776.55755:2012052,54.70843:2799 57.41559:2714 59.01277:17586 78.95799:45656 79.33981:3090 87.36868:4050 140.01106:23978 174.12358:3660 196.03819:13767 229.19635:4121 267.2709:11674 273.27332:3817 279.23514:14455 280.23795:18265 281.24139:11413 283.24258:23271 284.27219:4868 285.26981:6972 318.69775:3457 327.2359:17750 328.24005:5629 329.25018:9239 446.30591:6579 464.31549:23063 471.23239:3734 671.7569:4255,774.55084,774.55084
M777T776,776.5663447,775.993,0.823350639,0.071818346,0.782009745,NS,0.132716734,-0.354741509,1.143764599,neg,2.98922675,5.491708437,1.735277444,0.781430142,1.922878829,2.109787455,4.024881209,1.700837186,1.064376443,2.141761773,2.425345326,3.153872499,1.563756451,4.037329789,2.129866664,1.681594697,2.988764887,2.036777822,3.204222112,1.235244886,1.418592616,3.824247288,2.320468444,4.108303946,3.465719052,4.644067713,5.712487727,0.534724835,2.584354391,3.578537966,2.020493556,4.703719224,1.405815986,3.349201002,4.522823586,3.250267438,2.551667599,3.122707975,3.928124442,2.074414617,3.054459995,1.953962529,1.226041295,3.280320196,3.559525801,3.280597728,1.835409932,3.805299694,776.5624619,776.5702275,Ns,PE O-40:6|PE O-18:1_22:5,D,776.56708,12.939,7842,[M-H]-,C45H80NO7P,EtherPE,QIJJGYHBXLEBJV-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCC=CCC=CCC=CCC=CCC=CCC,20.6,49.7,776.56714:2940708 777.57049:1757889 778.57385:358652,55.71141:3857 55.98132:3199 56.12318:3029 59.01271:180654 71.01292:6341 78.95805:328632 81.51311:4048 83.04927:4177 90.76602:4017 91.86255:7963 96.96916:5009 101.13078:4088 103.63209:4050 113.69567:3474 122.00058:12163 134.985:5724 137.00056:11565 140.01135:118296 152.99593:6680 160.33421:3791 163.01657:16831 164.22708:3871 166.0275:6949 168.04298:17283 178.02762:5838 179.03529:10669 181.12428:4521 191.10793:7750 196.03839:93322 197.04271:4658 205.19609:11926 231.21278:15784 255.23448:671702 256.23727:6166 259.24481:41787 260.24643:7399 267.27112:44024 268.27505:6054 283.24435:5474 285.22864:6224 285.26025:50147 286.26477:11705 293.28723:21291 303.23508:267521 304.2384:55273 327.23535:7938 329.25098:352846 330.25449:81403 331.26297:6428 352.80658:3745 377.25003:8413 400.87213:4224 403.26465:4071 429.28162:4444 446.30774:33753 447.30496:5142 448.32318:20794 464.31772:55243 465.32153:14309 466.33389:34704 472.32227:19874 473.33032:5123 490.33569:38263 491.33847:14575 627.52527:16126 704.56964:6267,776.56708,776.56708
M777T796,776.5667848,796.241,0.691686074,0.125056308,0.823619139,NS,0.20641568,-0.279950739,0.902894397,neg,2.547413341,4.007703222,3.551416588,1.038790926,3.644127253,2.284990531,2.973719956,2.587461573,1.09019616,1.382309856,2.456596179,2.253993776,2.105327583,3.122376719,2.420041685,1.004440692,2.724937605,1.267436062,2.824900639,0.891749027,1.364345009,3.869018312,5.169082094,3.623445257,2.285639179,3.786647497,4.843748665,0.731582459,2.04671219,4.29348407,1.712217306,4.755331107,1.648689143,3.368160509,2.920235633,2.32589939,3.166078239,2.839137653,3.275714857,1.733630421,2.214770133,1.830049368,1.90080072,3.75619778,3.830206347,2.924985045,1.796756027,3.091605631,776.562902,776.5706676,Ns,PE O-40:6|PE O-18:1_22:5,D,776.5675,13.273,7843,[M-H]-,C45H80NO7P,EtherPE,QIJJGYHBXLEBJV-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCC=CCC=CCC=CCC=CCC=CCC,28.7,49.8,776.5672:1278315 777.57055:517496 778.57391:179751,54.46925:2728 59.0127:39515 74.77621:3524 78.95798:67968 140.01134:40737 163.07553:3428 177.16527:3323 196.03847:37045 203.18103:3950 210.63373:4183 223.19954:4169 231.21272:9252 255.23509:12042 257.22775:8403 267.27084:16247 279.23495:9259 281.25034:7632 282.25308:6630 285.26056:36637 286.26358:10280 301.21939:17551 329.25089:86441 330.25476:18992 331.26172:4869 439.97504:4188 446.3074:11984 447.30923:4509 464.31912:31386 465.32019:8281 474.34015:4519 627.52661:27581 628.53247:4536,776.5675,776.5675
M779T813,778.582367,813.07,1.33678088,0.000165876,1.550303307,NS,0.000966883,0.632550497,3.780216972,neg,2.369111641,2.791084498,2.215001401,0.528280603,1.978603978,2.924669349,2.607629868,2.806671045,1.268532471,3.577202926,1.876793337,1.768989052,1.465993894,1.586970307,3.53303412,1.893847984,2.825772085,2.307525663,1.699185646,0.560349404,3.597912458,1.670563098,2.347675753,3.031591327,2.392278665,2.671864288,2.578723503,0.366793751,4.21478153,3.970673561,3.415653305,3.292832752,1.075452852,4.470657944,1.97288894,2.788888875,2.861759733,3.875326962,5.14559558,3.756118883,3.15330501,2.271571458,1.423068744,4.064246659,3.709154538,2.195079321,2.373129237,2.239189308,778.578474,778.5862599,Up,PE O-40:5|PE O-18:1_22:4,S,778.58301,13.558,7875,[M-H]-,C45H82NO7P,EtherPE,YARMYJKPPFMPIW-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCC=CCC=CCC=CCC=CCC,44.3,49.1,778.58301:1261353 779.58636:741207 780.58972:237824,59.01272:35564 61.98731:17788 64.90086:3147 70.2241:3357 71.01295:5757 78.95801:63496 87.30268:4943 91.86443:6123 103.78202:3073 105.98888:3453 122.00005:3570 140.0116:28138 163.01694:5540 183.86691:3343 196.03856:16934 217.00467:27371 219.97803:4498 243.72377:3719 255.23514:19093 256.23636:4302 267.27145:12477 287.27612:5101 303.23306:5901 331.26675:183671 332.27005:45552 370.36725:3838 374.99374:4947 446.30713:10618 464.3187:21443 465.32214:6511 538.98431:4556 627.52576:14078 628.53192:7247 694.17169:4648,778.58301,778.58301
M779T827,778.5824504,827.046,0.842230401,0.026062951,1.350020532,NS,0.059736777,0.432981349,1.583976407,neg,1.847680977,3.374709463,1.818632274,0.811602526,2.463306965,1.659180907,2.186006089,2.747156087,0.82771933,2.550721879,1.204648883,1.185465855,1.753651314,1.632079116,3.8296354,1.277280449,3.444324417,1.085500776,1.977058236,0.76470755,1.968338562,2.895335999,1.87277611,2.38576389,2.404154679,2.708929434,2.216089927,0.410921687,3.259023522,6.106023331,2.823099585,3.00998388,0.885143883,3.870978282,1.603029811,3.179870371,3.564060391,2.576015823,3.300330579,3.580385345,3.102825193,1.737153937,1.273191515,2.453968656,1.588080795,1.878336031,1.641938571,1.522901942,778.5785575,778.5863433,Ns,PE O-40:5|PE O-20:1_20:4,S,778.58289,13.796,7874,[M-H]-,C45H82NO7P,EtherPE,QVNQNWKELAFJOX-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,36.5,48.4,778.58289:3460371 779.58624:2353361 780.5896:617030,59.01276:21073 61.98724:3899 78.95804:44701 91.865:9811 113.46352:3551 140.01114:22205 195.57303:4149 196.03818:19371 217.00432:7252 255.23442:8615 259.24448:15324 295.30161:11376 303.23499:118086 304.23813:25441 331.26651:22761 331.30118:3930 440.46625:3894 457.0986:3407 474.33896:4660 492.34732:16826 493.35059:4926 627.52722:22148 628.5249:10125 722.39209:4128,778.58289,778.58289
M781T835,780.5991281,834.844,0.436735866,0.826689479,1.023012425,NS,0.876008617,0.032823667,0.08265759,neg,2.295734731,3.237582043,1.675181809,1.99445964,4.347182089,3.21763426,2.395533081,2.213499612,1.137241812,2.389074535,2.450112233,1.222101941,2.704572553,2.308451285,2.040055097,1.569521868,2.470015944,2.097657646,2.381072784,1.828808993,2.423180157,3.559198629,2.139014518,3.348655329,2.611573537,4.341010838,3.689933918,0.60597337,3.553446035,4.429601024,1.46642063,4.865061418,1.781652812,2.679378196,2.798198505,2.564172151,3.125687549,3.493236239,4.132126081,3.297499536,2.635395318,2.289989242,2.462907452,2.923898632,3.086883538,2.700944285,2.376375142,2.245154777,780.5952251,780.6030311,Ns,PE O-40:4|PE O-22:2_18:2,S,780.59912,13.922,7896,[M-H]-,C45H84NO7P,EtherPE,RLNSISHYNDKQEW-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,40.2,42.8,780.59894:396892 781.60229:237520 782.60565:78420,55.27087:2918 57.72756:3633 59.0127:18537 60.34249:2782 61.77187:3100 61.98722:28167 68.92909:2969 71.40063:3507 78.95799:40242 84.28093:3384 140.01163:18101 140.15613:3222 146.72838:3908 185.0858:3596 196.03822:5671 217.0042:15952 219.97812:10478 236.21725:3848 259.24435:4096 276.01031:3882 279.23462:215660 280.23776:38864 281.24994:7776 294.20142:3810 302.35022:4535 303.23529:41797 304.23914:11427 321.31842:7819 329.34988:3631 361.92429:4791 374.99561:6081 431.29877:3967 433.31473:4873 494.36481:6794 500.3515:8135 518.36407:8256 567.7995:3720 717.82837:3837,780.59912,780.59912
M782T662,781.5563793,662.327,1.332236481,0.000377539,0.487882267,Down,0.001939495,-1.035395047,3.423038704,neg,0.246930299,2.759802688,0.305159089,2.033114657,1.602842164,1.40911331,2.806998791,0.285979039,0.401266291,1.352909893,1.560146744,1.988806412,1.407175381,0.82484182,0.426092813,0.732481182,0.747624328,1.000076498,1.607581111,2.36293732,0.181002454,2.003456322,1.342785789,3.875842079,0.658354849,0.963517427,1.099370641,0.792573192,0.940348789,0.723433871,0.509236447,1.591549208,1.699342354,0.444344191,1.057201652,0.658058702,0.644037754,0.454968223,1.604157574,1.624674042,1.162928287,0.439807301,0.349843322,0.989564462,3.061574336,0.538462877,1.036118905,3.081956248,781.5524715,781.560287,Down,CL 80:6|CL 26:0_18:2_18:2_18:2,S,781.55743,11.029,7906,[M-2H]2-,C89H162O17P2,CL,FTQIZXDULZKFMH-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCC=CCC=CCCCCC)CCCCCCCC=CCC=CCCCCC,43.9,23,781.5575:209360 782.56085:138068 783.56421:21304,55.65927:3097 59.01299:4140 59.99971:2598 60.64828:2752 69.97287:4119 78.9581:14215 82.17602:3418 83.01848:3177 84.55536:3399 96.96863:8428 101.05982:9349 152.0121:4503 152.99525:12270 190.91293:3454 271.04208:3334 279.23462:165004 280.2384:24969 283.26593:79936 284.26944:13081 315.19788:4052 464.29376:3835 466.88956:3959 733.42169:3760 737.63898:5628 771.04578:4719,781.55743,781.55743
M783T780,782.5388794,780.106,1.040088009,0.011400249,0.761146303,NS,0.030760485,-0.393754308,1.94308566,neg,2.800795993,4.806717584,2.512303386,2.142753318,3.367206952,3.242358505,5.406490969,2.164406212,1.179214048,2.27015799,4.189175148,2.847564806,2.599334661,4.445448831,1.774418723,1.597745767,3.407975055,1.952827629,4.524398543,2.022351053,1.415555319,3.665546943,3.562447363,5.362817687,3.117925303,3.525710534,4.664531266,1.169352358,3.079106506,5.882779313,1.704343057,4.308275395,2.204928258,2.933465001,3.035405426,3.489613639,2.506387806,2.805525465,4.924194856,2.073082953,2.640689477,2.240739196,1.916309549,4.564001547,4.005092693,3.495601661,2.793602037,4.140064532,782.5349667,782.5427921,Ns,PE 38:4;O|PE 18:1_20:3;O,S,782.53918,13.001,7914,[M-H]-,C43H78NO9P,OxPE,NFXRWRNJHCHMDK-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCC(O)C=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,51.9,35.7,782.53925:250383 783.5426:133404 784.54596:35794,59.01262:7089 59.11114:3050 61.98713:19162 68.05278:3155 69.89588:3857 71.57913:4534 78.95793:24349 86.06237:3079 87.30876:3638 87.35252:3670 87.70007:3715 140.01151:13426 179.49677:3405 196.03839:5964 239.23825:6356 253.21895:9138 255.23436:61403 256.23813:19511 269.92273:3429 281.25034:186784 282.25461:32217 297.27954:5558 303.23438:9615 418.27646:4567 419.27701:3558 436.29004:4665 465.96887:3951 474.76541:3818 674.23718:4269,782.53918,782.53918
M783T882,782.6141408,881.503,0.630930224,0.177088573,0.848818819,NS,0.272036495,-0.236471453,0.751809463,neg,1.697200258,2.899793716,1.966040542,2.938541895,3.561710548,4.001705052,3.329850676,2.527364264,0.679249979,2.926282313,4.089504053,1.669779905,3.400301112,3.493528168,1.611146372,0.993348313,3.390313596,1.035028778,3.551342128,2.930237705,1.904751708,3.04661539,2.21701987,5.476807114,1.734908257,4.089311834,3.707796919,0.502761932,3.562515944,6.151188794,0.77005912,4.796063403,1.959456991,1.853671065,2.409235779,2.930141796,3.531364809,1.949111847,2.771675903,4.288720182,3.701017115,2.63219341,1.390384512,3.526194118,1.966583492,3.16364462,3.264713269,3.022276611,782.6102278,782.6180539,Ns,PE O-40:3|PE O-22:1_18:2,S,782.61493,14.69,7917,[M-H]-,C45H86NO7P,EtherPE,PXGDKMWJZYBRIJ-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,57.5,43.6,782.61493:359496 783.61828:174873 784.62164:54819,59.01264:14510 61.98719:38538 69.97672:3324 73.22635:3051 78.95807:27773 79.05299:3341 103.62917:3484 106.14182:2956 113.48586:3013 127.0006:8934 140.01128:17225 141.01646:13748 163.43109:3904 196.03841:9631 217.00526:5407 219.97897:5940 261.22528:3882 279.23468:283971 280.23807:47114 281.24936:6980 307.26596:4145 323.33594:4023 348.39633:3736 400.90814:3620 450.19913:4261 474.7056:3571 502.36966:6604 507.60727:3660 520.38422:13722,782.61493,782.61493
M789T620,788.551849,620.377,1.514891697,0.000119302,0.488283402,Down,0.00074011,-1.034209356,3.923350592,neg,1.06558066,4.146549146,1.223614957,2.600649649,4.577037981,2.775188009,8.293589357,1.729061668,0.76120366,2.233488466,3.018177013,2.656526698,1.296739885,2.288241532,1.458625175,0.746219516,1.13321855,2.133141439,3.725086176,2.613001399,1.528448063,2.617766954,4.907732849,5.359702668,3.11141285,2.187045846,2.3545452,2.061360441,2.307048124,2.111599127,0.858776488,6.890783822,2.233450202,0.808289349,4.39042241,3.020120241,1.344439187,1.030023727,2.048650859,1.205402708,1.46722029,1.057124369,2.160277953,3.532887821,3.355368374,2.086063505,2.960114777,2.760782688,788.5479063,788.5557918,Down,CL 81:6|CL 28:0_17:2_18:2_18:2,S,788.55225,10.329,7982,[M-2H]2-,C90H164O17P2,CL,UYIAJPDEQLATTC-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCC=CCC=CCCCCC)CCCCCCCC=CCC=CCCCCC,24.3,26.8,788.55243:4053278 789.55578:1868113 790.55914:518200,55.96869:3283 58.87602:2814 59.0127:72867 61.98721:20841 62.2506:3506 72.2001:3712 74.75936:3472 75.26633:3488 78.95803:120475 96.96876:58303 115.39836:3819 138.17085:3350 152.99561:12226 168.04308:36565 169.04608:4874 217.004:6618 219.97917:8892 224.07001:8051 227.20255:131048 228.20589:16108 253.21863:97953 254.22289:8748 259.2442:6179 265.25513:8731 279.23459:241792 280.23831:41161 303.23529:60098 304.23889:9994 329.2511:9551 344.79642:3514 372.20496:3689 401.24872:6950 419.25867:4662 520.13068:3845 561.50684:3914 712.55438:7668,788.55225,788.55225
M789T675,788.5300651,674.744,0.496056493,0.24208021,0.821814305,NS,0.347891776,-0.283115653,0.616040712,neg,1.037151065,1.796301848,1.192991119,4.281366717,4.576605048,1.952417231,4.659521336,0.621488274,1.512353252,2.569851363,1.930393013,2.003523851,2.424354775,1.182321635,3.232332238,2.495217062,2.952915695,1.122292406,2.313666402,4.696801453,0.821950745,4.104907641,0.873843574,5.943639679,1.949466012,6.511888774,1.824894052,1.54672214,1.386845653,4.446937364,1.880193616,2.30547136,2.256411979,1.621470927,2.801669873,2.230547596,0.973770629,1.057930394,4.089952194,4.226703387,3.039858046,1.34729326,1.544027458,1.192114339,3.652793995,1.011096449,2.545640183,2.7667661,788.5261225,788.5340078,Ns,PE 40:7|PE 18:1_22:6,S,788.53125,11.257,7980,[M-H]-,C45H76NO8P,PE,JZSZAGWWWKKXLO-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC,3.4,53.1,788.53119:1397418 789.53454:776533 790.5379:0,120.88317:6316 122.98473:92095 132.83237:6292 140.01128:35309 149.69669:7072 152.99574:11459 166.23714:7445 168.04309:3529382 169.04697:166837 170.04739:26784 196.03856:29149 224.07063:28860 227.20244:133838 253.21873:991765 255.23441:540107 259.24286:9901 267.26974:15384 281.25034:735275 282.25256:58667 283.24509:42239 284.24719:13764 303.23474:110216 327.23544:60600 328.23685:19570 403.26273:12968 411.36224:10545 447.30099:52129 448.30566:15245 452.28214:13763 476.32111:12447 478.2984:18558 480.31406:18253 532.05475:9898 536.44006:9967 642.49457:30694 713.56573:2768550 714.56909:1587662 715.57214:387362 715.66626:7875 716.52924:43357 716.88904:12551 762.5611:11760 788.56116:11978,788.53125,788.53125
M791T733,790.5462997,733.471,0.625554611,0.108918098,0.764983234,NS,0.184875987,-0.386499966,0.962899951,neg,1.367711092,2.271952961,1.818157667,7.379204845,5.736094039,1.358043813,5.516329816,0.868030128,2.6712009,3.158484183,1.670199421,3.170813215,2.82716792,1.190813497,4.373182268,2.956162716,3.724088268,1.079826532,3.37805899,7.087290479,0.728971447,3.88980839,1.575697429,4.27464705,2.254416145,4.865621462,2.107841621,2.165671515,1.654606348,3.717483426,4.154259061,2.71463622,2.217607877,2.001902199,3.121901371,2.445063059,2.202002903,1.787114361,4.56697342,5.135755545,3.00593682,1.901330836,1.725129542,1.459622236,2.534378595,1.170050789,1.366014884,3.457061197,790.5423469,790.5502524,Ns,PE 40:6|PE 18:0_22:6,S,790.54688,12.234,8010,[M-H]-,C45H78NO8P,PE,XYYHNDVKALDFHQ-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,33.1,42.4,790.54694:6635307 791.55029:3547977 792.55365:687454,59.0127:43827 68.22157:3374 78.95802:212430 79.22138:3120 96.96879:57932 122.00082:5442 140.01126:42293 149.47423:3406 152.99615:4869 168.04298:95017 169.04695:3740 196.03847:25476 201.41701:3662 214.23721:3593 217.00404:10574 229.19678:6384 233.05338:4284 253.22009:9387 255.03778:3606 255.23405:43612 279.23453:58734 280.23801:18480 283.26749:195891 284.27106:41601 327.23544:35205 328.23895:10614 480.31265:6350 632.474:3995 715.57977:18142 716.58392:14547,790.54688,790.54688
M793T752,792.5586112,751.61,0.834234995,0.025432687,1.368917467,NS,0.058614292,0.453035468,1.594607759,neg,1.486049453,1.278800105,2.962464695,4.242578358,4.051620613,2.346586603,4.6111883,1.156598091,1.626613247,5.043385873,1.328982171,1.884438425,2.3045702,0.793264057,3.16668681,4.120834017,3.385053251,2.683094777,1.805288198,3.771443098,1.788538534,2.407524106,2.285982043,2.46649314,3.412746868,5.05052167,0.99992508,1.497311295,2.145788614,4.513456482,3.440591412,1.781042503,1.328644485,2.334517707,2.067370695,1.847314659,1.616187163,2.022394864,6.266411478,3.543464684,3.609601949,2.601943423,1.636788116,1.910788173,4.206078771,0.859243048,3.917139734,2.677760332,792.5546484,792.562574,Ns,PE 40:5|PE 18:0_22:5,D,792.56049,12.536,8034,[M-H]-,C45H80NO8P,PE,KYERVKWKQQBRQB-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,46.4,46.9,792.56061:678672 793.56396:392125 794.56732:121567,57.42707:3369 59.0127:26779 62.75498:3176 72.80976:3164 78.958:54773 79.00772:3214 81.77596:3227 87.13879:3068 87.22005:3339 96.9683:3700 106.10972:3660 122.00029:6556 140.01144:28065 168.0432:13140 196.03867:13622 211.13292:3590 255.23438:84197 256.23761:10115 283.26624:120057 284.26944:22207 285.26053:8431 303.23456:18273 306.05475:4563 309.28214:22531 329.25067:72550 330.25366:20592 535.29797:3964,792.56049,792.56049
M793T773,792.5602643,772.6975,0.286061384,0.581106154,1.103566984,NS,0.677528798,0.1421742,0.235744525,neg,1.186593804,1.724672474,5.933668355,2.102444869,7.403977794,4.187910654,5.356592654,1.53818507,1.012555405,3.597483417,0.902656877,1.852686971,1.193902325,0.663541057,6.0361943,1.989925277,1.723747315,1.131184038,2.172509637,1.92509875,0.729409818,4.781633173,4.355209093,2.497641945,1.387804971,4.196452925,0.853402944,2.309663605,1.488497646,4.160815542,3.473829093,3.434380941,1.360445623,3.40012043,1.917454629,2.315597318,2.941517433,1.147130919,4.143139071,3.449051392,3.305534963,1.644800108,4.054008952,3.698031135,5.031243696,0.781606123,2.706758648,3.385754975,792.5563015,792.5642271,Ns,PE 40:5|PE 18:0_22:5,D,792.5614,12.876,8035,[M-H]-,C45H80NO8P,PE,KYERVKWKQQBRQB-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,43.1,47,792.5614:657451 793.56475:457847 794.56811:159607,59.01274:34936 61.98737:3902 64.32983:3667 68.92558:3228 69.64785:3696 69.89012:4240 78.958:61317 88.96786:3206 91.86257:6960 92.57809:4118 106.0872:3358 120.70679:4375 121.11172:3302 122.00082:4622 140.01149:35832 168.04372:20855 196.03874:25169 217.00308:3808 255.23448:149722 255.26183:7034 256.23746:34974 281.24945:7962 283.26617:162343 284.27017:24503 285.26105:26185 329.25165:68420 330.25534:14451 343.42728:3682 480.31259:9331 494.0322:3985 717.58459:3952,792.5614,792.5614
M795T790,794.5776056,789.5935,1.100901838,0.002499771,1.469761001,NS,0.009128198,0.555581576,2.60209983,neg,1.744586327,2.159659746,2.692430149,1.569414943,3.801799441,3.717564335,4.591705454,2.205515889,1.332992012,5.064493948,1.023826704,1.821984034,1.346755291,2.377972296,3.887308222,2.392385857,2.187963614,2.061531136,1.666470557,1.576318253,2.222497969,2.593620791,2.76272991,2.186806176,2.611561005,3.47698259,1.721130697,1.304141042,2.753223006,5.840916787,3.572305372,2.450687796,1.034371593,3.871317273,2.047232056,2.164478563,2.065385879,2.282929034,4.702101642,3.08985619,3.701390732,2.059690566,2.037503617,3.563250424,5.9390236,1.035668381,4.292213515,2.252730311,794.5736327,794.5815785,Ns,PE 40:4|PE 18:0_22:4,S,794.57794,13.162,8064,[M-H]-,C45H82NO8P,PE,TVACGFJBGVEGCR-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC,57.3,47.7,794.57794:515108 795.58129:311215 796.58465:83140,57.95893:2812 59.01278:23730 61.98733:12591 64.48394:3371 78.95805:34462 104.4382:3442 106.23028:3086 112.60652:3278 122.00121:3903 140.0114:29275 196.03926:17280 213.45372:3612 226.0714:3702 255.23387:29024 256.23825:4958 269.25034:10177 279.23471:51330 280.23938:8361 281.24954:4986 283.26608:140096 284.26956:24306 287.27585:7994 331.26654:146788 332.27011:34398 493.76031:3525 737.55115:5947,794.57794,794.57794
M803T810,802.5831637,810.284,0.464491933,0.305591202,0.884744769,NS,0.416329342,-0.176666768,0.514859154,neg,2.5472678,2.940399405,1.3493932,2.415208559,4.127390729,1.680145304,2.877878332,1.951883981,1.442037655,1.850042318,2.712977844,2.283832322,2.82715885,3.389575769,2.200113648,1.698476671,4.717283936,1.304534088,2.893108201,2.375374609,1.704351931,3.50926786,2.693867391,4.070364783,2.98380964,3.792164587,4.287342476,0.540330292,3.632165611,6.455013644,1.263676499,4.978722191,1.936633178,2.998622764,3.497864632,2.549546785,2.545498148,3.027414311,4.045225328,4.956079796,3.235252666,2.093342494,1.335349056,2.319452237,1.706366439,2.701796865,1.304928911,2.127396719,802.5791508,802.5871766,Ns,PE O-42:7|PE O-20:1_22:6,S,802.58362,13.502,8148,[M-H]-,C47H82NO7P,EtherPE,GWWKPJFGKBNJDJ-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,24.2,45.4,802.58374:1111338 803.58709:733467 804.59045:189623,59.01271:32255 61.98731:5723 78.90987:3094 78.95802:71181 91.86482:6011 96.25385:3288 98.42508:3250 122.00085:6049 133.10176:5450 140.01155:31686 158.60208:3349 163.0168:7485 183.56918:3149 196.03865:31722 214.55881:3447 229.19701:6163 255.23431:10817 281.25079:31717 283.24506:28075 284.24884:8836 295.30142:16721 327.23578:35382 328.23846:9496 362.71051:3794 398.11475:3588 474.33887:14657 492.34946:30149 493.35205:5354 737.43457:5350 738.66919:4334,802.58362,802.58362
M805T719,804.5234371,718.953,0.779262897,0.076435166,0.803879414,NS,0.139376437,-0.314948988,1.116706786,neg,3.47247893,5.63825488,3.446568993,1.142066943,3.472418931,2.714625032,4.934284927,3.17471222,1.216187683,2.407925699,2.979698759,3.70190616,2.749468116,4.470492205,2.678557987,1.201633213,4.34036314,1.958300488,5.401472892,1.073327076,1.55864697,4.881386879,3.564265503,3.689823789,3.428411221,4.937377745,4.480092829,0.995828569,2.403841931,6.162395457,2.164083052,5.481013046,2.163331434,4.519942135,2.99648488,4.979220292,2.587463631,4.050050648,4.788699572,2.061643998,3.379057137,2.120890963,1.713084551,4.03317213,3.609364416,4.104576922,1.921103837,5.198997033,804.5194145,804.5274597,Ns,PE 40:7;O|PE 20:4_20:3;O,S,804.52399,11.99,8163,[M-H]-,C45H76NO9P,OxPE,ONZPXIOGDCMVPR-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCC(O)C=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,19.7,32.7,804.52393:1419723 805.52728:888336 806.53064:222123,57.21278:3172 59.0127:102867 59.91903:4149 60.0161:4029 60.85239:3529 61.98723:185751 65.28295:3213 71.01287:4639 78.95803:134998 80.9624:4547 83.04939:3353 104.51851:3385 118.83721:3631 122.00019:4510 140.01115:32280 152.99541:5199 163.01665:9700 166.02728:3405 168.04308:37361 169.04625:4845 176.1123:3726 178.48384:3330 196.03888:31068 205.19707:7416 219.46881:3760 220.6339:3430 224.07022:6837 239.23845:29866 240.2422:9017 241.21863:18578 243.53793:4256 253.21915:29900 254.22244:5836 255.23473:74837 256.23727:12060 259.24463:27194 260.24554:7971 267.23483:114961 268.23846:20764 269.24893:6227 279.2348:186264 280.23807:188788 281.24323:115783 282.24612:18704 303.23505:288877 304.23862:55127 357.46539:3809 375.23584:4315 418.27512:19634 436.2868:40293 437.28912:11447 447.31259:4818 448.31506:5336 465.32065:5860 466.32462:13316 623.15753:4043,804.52399,804.52399
M805T824,804.5977891,824.043,1.385979832,3.17E-05,1.678097994,NS,0.000242468,0.746826965,4.499379496,neg,2.030744452,2.321051801,2.074222069,1.3044037,2.702003929,2.74770741,2.159390445,2.049105553,1.325305466,2.929110511,1.550866149,1.072786704,2.556920062,1.85701588,2.981901652,2.815863503,3.465621734,2.326177664,1.664547573,1.235750545,2.864806836,2.688072856,1.481230442,2.456659149,2.865864901,4.662586815,2.505840677,0.347209036,4.364821832,6.230652975,1.959543035,3.25223666,1.150321978,2.889418068,2.006585022,2.195649435,3.185540345,4.556629929,6.373869314,3.485239222,2.509510859,2.851571772,3.093216293,3.66625393,2.103524069,1.845826452,2.515673011,1.43918308,804.5937661,804.6018121,Up,PE O-42:6|PE O-22:2_20:4,S,804.59857,13.734,8167,[M-H]-,C47H84NO7P,EtherPE,SYZKTPNEFMFVSV-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,37.3,48.2,804.59857:692255 805.60192:410243 806.60528:100110,59.0127:39279 61.98722:4224 78.95809:54998 87.33366:3239 88.88045:3536 91.86826:4638 109.92995:3462 115.14497:3326 138.37769:3546 140.01125:23901 163.01596:5929 168.04305:4191 170.62062:3647 179.03642:3785 196.03836:19925 205.19751:3490 244.90022:4398 255.23415:65592 256.23798:7515 259.24606:19112 281.24973:11722 282.25305:3703 283.26572:10116 287.39166:3998 303.2352:124686 304.23871:30979 321.31934:8249 500.3558:7246 518.36865:19143 557.28864:4254 737.34467:5633 744.87793:4433,804.59857,804.59857
M807T872,806.6143157,871.5225,0.700707595,0.090614093,1.278569492,NS,0.159413363,0.354530575,1.04280425,neg,2.587976205,2.565819744,2.855509139,1.195193793,3.589282845,2.631196839,2.647156346,2.758182875,1.055291439,3.801167146,1.5843067,1.212998217,2.500273656,2.132205651,3.060702344,1.793059917,4.873626049,1.148874946,2.850039255,1.173771628,2.095623547,4.347959661,2.132394614,3.195062531,3.336050987,3.253290285,2.956490644,0.557521355,4.847722249,9.323387119,1.531805128,4.422262201,1.248621952,3.339811105,1.760374027,3.145840683,2.473607625,2.921822529,3.882335426,3.523599675,3.532820603,2.188958526,1.76246962,2.872671465,1.650733896,2.598682377,2.765053297,1.816837799,806.6102826,806.6183487,Ns,PE O-42:5|PE O-22:1_20:4,S,806.61505,14.522,8186,[M-H]-,C47H86NO7P,EtherPE,HZKJVUODVASPTC-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,53.7,48.3,806.61505:704544 807.6184:389461 808.62176:125565,59.01272:24983 60.20282:3021 61.98719:6168 64.41873:3385 69.82645:2867 78.95802:55996 106.34534:3784 121.98091:3437 137.06929:3534 137.20061:3700 137.76198:3809 140.01112:16063 145.31645:3368 196.03726:17484 205.19682:4297 217.00327:8566 254.39348:4128 255.23378:5208 259.24319:17021 259.85416:3693 260.2485:4047 303.23492:138886 304.23877:30244 323.3342:13351 401.07541:3593 502.36853:5473 520.37994:23580 521.38153:4643,806.61505,806.61505
M809T877,808.6304136,877.397,0.541487498,0.341177995,1.09800016,NS,0.452800079,0.134878265,0.467018987,neg,2.152807862,2.858436923,1.824113625,2.7666532,3.965917176,3.23182105,2.31658476,2.123910786,1.261776412,3.167247667,2.74531472,1.042000441,2.969441677,2.169511238,1.827909992,1.872749593,2.901359989,2.362990972,2.081714068,2.43008059,2.946977096,2.983502911,1.857405761,3.869681608,2.147515173,4.259946409,3.106798431,0.593866828,4.239868723,4.302133905,1.300338657,4.420832968,1.819175444,2.559114841,3.041260833,2.281749755,3.116382833,3.319133031,4.333059039,3.933430112,2.762841442,2.832701021,2.633390226,2.897668378,2.505781513,2.553368057,3.028121044,2.367625925,808.6263704,808.6344567,Ns,PE O-42:4|PE O-24:2_18:2,S,808.63049,14.62,8203,[M-H]-,C47H88NO7P,EtherPE,JGINIYCBGDWCQU-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC,46,44.1,808.63049:363803 809.63384:215840 810.6372:50287,59.01258:8145 61.98723:10751 78.958:22834 91.86681:9386 140.01195:6878 192.86014:3687 196.03932:4256 206.98308:3605 217.00397:15383 219.97897:5078 279.2348:126936 280.23874:23923 303.23566:11973 316.95242:11624 349.34836:3805 546.39716:7772 606.1424:3666 621.38196:4258 667.76166:4114 737.41486:5124,808.63049,808.63049
M831T856,830.614926,855.896,0.334490517,0.555008983,0.919926229,NS,0.654297674,-0.120409922,0.255699988,neg,2.635977031,2.43563039,1.544221377,2.669829501,4.429430526,1.597157324,2.204687816,2.247748053,1.530827234,2.080449889,2.556620091,1.944127743,2.984465771,3.619302728,1.799084603,1.670341908,5.13316681,1.34124891,2.747674416,2.727699076,1.888953503,3.487112866,2.247608172,3.976238583,3.16144527,3.590330004,4.326767781,0.417189264,3.960825379,8.433464227,1.084814368,5.704733357,1.939573207,2.641309222,3.357881425,2.606750563,2.212692483,2.823328501,3.480934181,4.660595722,3.333858245,2.34529929,1.325628402,2.03351291,1.466794634,2.466334721,1.30656602,1.837448132,830.6107729,830.619079,Ns,PE O-44:7|PE O-22:1_22:6,S,830.61566,14.269,8451,[M-H]-,C49H86NO7P,EtherPE,CSMBIDUEPDMGNC-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC,24.4,45.2,830.61523:249002 831.61858:147182 832.62194:68107,59.01265:16065 61.40478:2948 61.98723:9706 74.76511:3167 77.48296:3162 78.95802:42227 116.47772:3402 129.68936:3441 140.01108:8340 168.04297:13455 181.13913:3594 196.03781:9590 223.63124:3783 279.23346:6113 281.24957:8303 283.2446:6655 317.84259:3431 323.33359:7942 323.51236:3605 327.20004:4103 327.23486:14101 330.82202:3323 331.73752:3403 390.29803:4161 435.55484:3814 502.3707:5346 520.38348:15136 618.09723:3586 736.2135:3712 827.77972:4202,830.61566,830.61566
M833T867,832.6302839,867.247,1.364078565,4.62E-05,1.726498336,NS,0.000334477,0.787848944,4.335465508,neg,2.140320894,2.30592375,2.2107306,1.388626316,3.039580436,2.908484451,1.853992149,2.172180177,1.148889551,3.425874922,1.365378877,0.767054896,2.370117264,1.637568258,2.703114279,2.705607258,3.161876999,2.097909773,1.514430316,1.402189225,2.837609782,2.800278454,1.28939002,2.29077762,2.694498096,4.759249489,2.71893261,0.398844434,4.932339731,6.861916202,1.831049616,3.394999509,1.215031732,2.651385092,1.909833959,2.111626339,3.051877262,3.954640948,6.012398201,3.879435594,2.371935773,3.097880615,3.581132216,3.107550159,1.904152728,1.766985961,3.324238933,1.193819843,832.6261207,832.634447,Up,PE O-44:6|PE O-24:2_20:4,S,832.63074,14.452,8476,[M-H]-,C49H88NO7P,EtherPE,PKINGLCDNYVYIK-UHFFFAOYSA-N,O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC,47.8,47.1,832.63074:646262 833.63409:460046 834.63745:114321,59.01265:22581 61.98721:3963 69.91052:4210 78.95805:89029 86.83954:3145 91.86439:6593 95.48268:3408 99.22381:3534 122.00095:6217 140.01138:38042 148.00055:3724 163.01677:5061 168.04324:5216 177.87233:3476 196.03851:27197 198.0681:4311 205.19731:6514 208.57187:4338 255.23604:5366 259.24509:27398 281.2496:7125 303.23499:219055 304.2384:42162 311.29694:6640 349.34979:12838 384.30673:3446 448.10849:3635 528.38635:14022 529.39014:7219 546.39825:26091 547.39941:10417 713.22607:3802 726.86414:4166,832.63074,832.63074
M834T584,833.52642,583.671,1.160385178,0.002626933,0.660945279,NS,0.009478036,-0.597397261,2.580551008,neg,1.810959296,3.319905294,2.931106941,4.874245751,3.341428638,5.854897526,6.30844604,2.510366557,2.369381943,3.763227124,2.86189453,2.617932695,2.314128499,2.229931923,2.105109786,1.420822547,2.270141578,2.449034828,2.926926817,4.650962808,1.675563971,2.118428928,7.540435259,3.769364192,1.678442596,1.772671539,2.663373673,2.509036993,2.608394799,4.133222472,1.789467752,5.71936677,2.168217998,1.293643564,3.943477176,5.316826714,2.380708868,2.047106851,2.721681103,2.055195273,1.565655955,1.899620801,1.991406948,2.69739382,2.954292667,2.766506123,4.44092923,3.467111888,833.5222524,833.5305877,Down,PI 34:2|PI 16:0_18:2,S,833.52679,9.725,8486,[M-H]-,C43H79O13P,PI,BSNJSZUDOMPYIR-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC,32.1,40.4,833.52679:4914198 834.53014:2695240 835.5335:735960,59.01265:7995 61.98724:11721 65.67622:4005 70.46628:3211 78.95801:135889 91.2683:3764 96.96871:39584 134.98451:4583 135.71359:3639 152.99554:79989 217.00314:4561 223.00244:39110 241.01318:148457 242.01582:5696 253.21889:8668 255.23436:253320 256.23801:35144 259.02383:12394 279.23468:234356 280.2377:40747 281.24854:9870 297.04025:13973 300.97131:4215 315.05112:4768 391.22781:14649 392.23184:4536 414.67416:4035 553.28265:16972 571.29132:4126 689.16266:4683 753.98633:4010 833.51978:16851,833.52679,833.52679
M836T638,835.54161,637.651,1.18043137,0.001379855,0.679509373,NS,0.00565091,-0.557434643,2.86016641,neg,2.361594368,4.955428978,4.149338071,7.177844759,4.183148096,6.343747755,7.974560575,2.980958116,2.435622216,3.322008231,4.232686,4.077842534,2.677329399,2.779425535,2.572489659,3.076777977,3.307425362,2.798618059,3.768353601,6.877925718,1.66287081,2.832256444,4.751530186,5.828445409,2.361002778,2.341961727,3.028648264,3.42595397,3.061513937,6.487648687,2.011043314,6.63849213,3.899370124,2.080652013,3.992834135,5.630840605,2.499019303,2.194294802,4.709539624,2.3130758,1.851732736,2.091194683,2.983890886,3.321872788,3.762906032,3.131884208,6.534181287,3.625618689,835.5374323,835.5457877,Ns,PI 34:1|PI 16:0_18:1,S,835.54224,10.621,8510,[M-H]-,C43H81O13P,PI,PDLAMJKMOKWLAJ-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC,29.4,40.2,835.54224:1962766 836.54559:993713 837.54895:280640,59.01268:4361 61.98727:12685 69.86009:3187 78.95799:126649 87.26448:4132 96.96873:37052 152.99551:77269 153.99931:4544 168.04297:4418 188.2413:3975 195.08084:4516 201.31358:3847 223.00217:28395 228.69594:4287 241.01315:150236 253.21875:8272 255.23445:218230 256.23743:40997 259.02411:9162 279.23495:4593 281.25043:227501 282.25375:41926 283.26434:19370 297.03943:11039 315.05121:5764 391.22827:13744 497.69681:3948 553.28381:16517 571.30426:4522 579.30499:5635 580.30908:3957 600.25269:3783 674.07318:4101 737.61755:4873 835.54248:11691,835.54224,835.54224
M841T812,840.6650607,812.3785,0.471116607,0.578004947,1.069500757,NS,0.674729467,0.096937504,0.238068444,neg,2.681766932,3.842467877,4.774241472,2.048867047,2.225980089,3.214085231,2.617450391,3.072484719,2.734157891,2.145508042,2.866924506,1.897113103,5.381028145,3.596744506,2.953926987,0.949941965,2.066135468,2.364466192,1.375971554,2.143410845,2.73793416,2.371843987,1.93364177,5.28214844,3.143467112,4.350807797,4.407064438,0.517236814,3.467861579,3.452797116,1.798127859,4.103709728,3.464480105,3.431677447,6.202014453,3.82073658,4.337868613,2.466467346,5.834074025,2.61889711,3.161864557,4.338205414,4.151007955,3.287550091,2.222625617,2.107399499,2.247778295,2.873379634,840.6608573,840.669264,Ns,HexCer 40:2;O2|HexCer 18:2;O2/22:0,S,840.66583,13.544,8574,[M+CH3COO]-,C46H87NO8,HexCer_NS,LWOBEIHJFQUNNQ-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC,34.1,33.8,840.66553:788355 841.66888:438574 842.67224:152286,59.01272:148298 61.98722:41970 69.16366:2998 71.01279:102660 72.99198:5523 73.02847:8520 78.95817:5299 83.01297:8166 85.02855:20714 87.0079:4457 89.02351:127085 93.04431:4115 95.01301:6531 101.02357:88995 105.19616:4565 109.93595:3790 113.02365:48924 119.03453:45055 130.94846:3439 149.04506:4793 235.20786:15220 255.2339:8001 261.22314:11437 264.23575:4559 279.23325:4587 303.23434:11455 321.31873:10768 338.34534:13152 339.3299:14669 362.34296:5639 364.36026:61262 365.36337:14822 380.3548:10879 515.39941:3994 570.56281:10419 588.57416:7818 618.58783:38063 619.59021:12064 651.74377:4914 737.47015:3921 776.95319:4169 789.21368:3739,840.66583,840.66583
M843T857,842.6810156,857.1025,0.156456013,0.680524937,0.949903791,NS,0.76203087,-0.074146695,0.167155956,neg,8.015874844,6.954189871,11.00294271,9.728343108,11.54212915,12.67711334,8.953116644,15.91881214,7.938964766,6.793427696,13.43498938,14.62362179,19.32254902,11.72578622,9.849635001,5.048204707,3.587228629,5.194581819,7.854567227,10.34975863,16.84899059,7.772965788,6.8565857,14.16059386,15.60006571,13.51729155,12.35844416,10.47771326,9.237501536,11.13937165,8.434462719,14.55518845,25.33279685,17.20734476,11.9213542,23.69627513,13.16375722,8.778261071,14.26880531,4.464288335,22.49897942,19.73397305,20.54749994,8.86851729,6.348509509,16.09249551,11.99238863,8.250110432,842.6768022,842.685229,Ns,HexCer 40:1;O2|HexCer 18:1;O2/22:0,S,842.68134,14.283,8602,[M+CH3COO]-,C46H89NO8,HexCer_NS,YIGARKIIFOHVPF-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC,32.6,33.9,842.68121:569223 843.68456:319472 844.68792:103162,59.0127:121852 60.0161:3994 61.98727:10186 71.01278:79644 72.91255:4183 72.99233:6091 73.02837:7511 78.95804:51761 83.01272:5553 85.02852:18337 89.0235:99314 95.01317:3768 95.33743:3208 101.02363:63204 102.02696:4575 106.76405:3227 113.02361:33721 119.03424:30739 143.03477:4271 168.04359:28790 198.00484:3326 201.2756:3722 217.00481:4985 237.22314:11830 238.2274:4155 263.24023:7715 279.23447:12706 283.2659:5187 321.3179:13878 338.34503:11168 339.32706:8355 364.36044:47201 365.36438:11886 380.35391:7320 414.28879:3925 534.93463:4188 572.57959:4885 590.59674:6661 620.60168:26796 621.60352:7929 769.63135:7686 796.3576:3923 837.06616:4190,842.68134,842.68134
M855T839,854.6821245,838.592,0.681362869,0.106965896,0.820087272,NS,0.182149277,-0.286150649,0.970754666,neg,2.859519127,4.67042796,4.439949811,2.607241289,3.728419391,3.063726559,2.170793858,1.510618754,2.549210428,2.103952571,4.036581433,1.772806281,2.954725916,3.317458058,3.225651622,2.335605445,1.715919747,2.618329048,1.283769405,4.967596247,2.756752983,3.319072288,1.880190319,4.513586371,3.667532817,3.147894605,4.612793334,0.399373291,0.699922239,2.727198926,2.172370143,4.898329971,3.369492319,3.176254316,5.463982415,5.39307931,3.350235853,2.850651764,3.578469384,2.59917172,2.6469998,3.48718483,3.405799493,2.822246442,1.788209078,2.396452288,2.371638457,1.938613022,854.6778511,854.6863979,Ns,HexCer 41:2;O2|HexCer 18:2;O2/23:0,S,854.68256,13.978,8758,[M+CH3COO]-,C47H89NO8,HexCer_NS,LIFQWWUBGFSGFL-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCC,31.4,32.7,854.68127:376722 855.68462:200948 856.68798:62950,61.9873:9115 62.84087:2801 65.37295:3099 71.01281:58825 72.99216:3033 76.04426:3363 78.95805:9302 81.80116:3622 83.01299:7642 85.02864:11581 85.79504:3624 89.02349:62501 90.02666:3828 91.86163:5091 101.02351:42263 113.02374:27962 119.03434:24435 147.81482:3830 193.48506:3479 202.9879:4597 217.00316:15597 219.97813:3749 235.20702:7650 239.68221:3337 261.22479:6483 279.23172:4528 335.33731:7606 353.34332:5684 374.99655:3892 378.37769:31269 379.37878:9971 394.37085:5538 584.58936:5296 613.30688:4898 632.60425:13603 633.60553:10822,854.68256,854.68256
M855T852,854.6814183,851.778,1.009378246,0.005376563,1.388106482,NS,0.016913104,0.473118241,2.269495223,neg,3.575498439,5.303908796,6.43285157,3.183627415,3.602445477,3.866617636,3.483721672,4.571545301,4.442503954,3.570026534,4.24961213,2.337132526,7.535717699,4.069230363,7.553325178,3.729571621,3.726918171,3.752765484,1.716304837,3.25427075,4.936746341,3.008953835,2.160410931,4.408059931,5.657622561,5.544871553,5.245720105,0.981141024,10.15649234,6.489575895,3.795315128,6.432398354,5.170525615,4.940827498,6.410062101,6.3985523,5.663697041,4.785520028,10.51106782,3.973861069,5.146199278,8.690598559,7.020312405,4.138762173,2.941213398,3.302734695,3.856570764,2.985495356,854.6771449,854.6856917,Ns,HexCer 42:2;O2|HexCer 18:1;O2/24:1,S,854.68237,14.192,8757,[M+HCOO]-,C48H91NO8,HexCer_NS,WBOZIXHPUPAOIA-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,32.1,34.8,854.68237:360193 855.68572:252646 856.68908:68089,61.98722:7172 66.48014:2993 71.01281:45244 73.8841:3070 78.95802:45259 79.42851:3124 79.6262:2843 83.0131:4777 85.02842:9275 85.60801:3362 88.36205:3764 89.02354:51354 99.16631:3256 101.02343:40735 112.24774:4511 113.02358:16944 119.03426:24833 123.81638:3731 133.1467:3171 140.01108:5327 168.04279:19669 237.22362:6821 283.24423:9027 305.44672:3842 309.28345:6163 327.23431:10266 347.33636:5081 365.34418:4602 390.3765:23725 391.38101:8726 406.3732:4068 467.89215:3827 546.40015:5474 646.61188:16712 647.62524:8357 737.54388:4287,854.68237,854.68237
M857T759,856.5547559,758.7745,1.348463286,0.000264295,0.663600098,NS,0.001431072,-0.591613995,3.577911798,neg,3.539988513,4.712040108,1.77590842,2.072573784,4.026533084,1.702788906,4.127594518,2.396713751,1.798858243,1.792814236,4.151817286,4.398507332,2.523771674,5.093754279,2.746412208,1.755111945,4.204774407,1.684017375,4.74733908,2.067650365,1.456192611,4.495324852,3.288350788,5.718856539,3.626366152,4.395374547,6.485391559,1.081724259,2.570220423,3.269548118,2.043434834,5.111718892,3.042224251,4.147678634,4.381701902,4.24398752,3.19870863,3.352326842,4.306025098,3.428370294,3.179394974,2.563762677,1.557597724,2.813794918,3.220036271,4.661186847,1.07005717,4.025803448,856.5504732,856.5590387,Down,PE 44:9;O|PE 22:4_22:5;O,S,856.55573,12.652,8774,[M-H]-,C49H80NO9P,OxPE,KEBHUKMFSPUIBW-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCC(O)C=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCC=CCC=CCC=CCC=CCC,38.8,37.3,856.55542:1050849 857.55877:766210 858.56213:203800,61.98721:25584 62.20715:3137 71.0127:5456 73.97635:3126 78.95803:150530 81.03828:3879 83.36338:3137 90.33372:4585 122.0006:5555 133.1012:5069 135.11758:4689 137.00034:5767 140.01143:31768 147.11807:3480 162.38185:3861 163.0762:5080 168.0433:35235 177.09151:4181 196.03836:29354 229.19832:9052 267.27145:20127 269.25058:13255 279.23395:19062 281.2485:4420 283.24292:36923 283.27206:6522 284.2467:5650 287.27676:13172 291.23447:4202 304.23621:4553 305.25104:27876 306.25314:8278 316.96201:4087 327.23538:56880 328.23828:10071 331.26657:306904 332.26993:124373 332.3103:7090 333.27289:17821 377.24689:6070 403.26636:4664 446.3074:21104 448.32416:14866 464.31888:41969 465.32159:10683 466.3349:33774 467.33582:14494 537.4057:4392 698.72485:4260 771.83459:4312,856.55573,856.55573
M858T573,857.5263958,572.659,0.554789219,0.18421298,0.825722156,NS,0.280712019,-0.276271679,0.734679772,neg,2.175282135,3.081790481,3.348596208,5.687071222,3.82682819,5.498281852,4.618028989,1.901684624,1.98507997,3.107673027,2.297127425,2.299234682,2.172859978,1.820752255,2.529820836,1.816546002,2.495079894,2.11482174,2.00085439,5.265712478,1.671210282,2.206792397,6.268402562,3.303661168,2.01589698,2.229417318,2.165152401,1.869790647,2.559664375,6.945737928,1.768125166,4.072896627,1.89867242,1.405456707,3.409415309,4.207364769,1.946109444,1.569029868,3.415733365,1.881541919,1.439585838,1.938032017,1.948631677,2.9290976,2.865586608,1.678743784,6.717039188,2.373709104,857.5221082,857.5306835,Ns,PI 36:4|PI 16:0_20:4,S,857.52655,9.536,8786,[M-H]-,C45H79O13P,PI,VWRYMIZQLPXULA-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC,22.6,32.6,857.52655:6434560 858.5299:3752100 859.53326:1162877,61.98721:15987 62.27889:4216 71.40261:3494 72.86337:3231 78.95354:3472 78.95803:107998 96.96876:26291 127.81289:3765 133.58051:3351 152.99556:60189 153.99963:4415 158.53145:3607 171.77881:3243 173.98729:3619 186.9566:3752 202.98831:7185 205.19754:4625 217.00279:17543 223.00223:22913 241.01305:112108 242.0168:5692 255.23454:178093 256.23795:28668 259.02328:9262 259.24411:8763 297.04001:10754 303.18063:4043 303.2355:86418 304.23801:14384 315.05127:6871 391.22845:10741 414.40002:4133 481.58295:4420 553.28412:11198 580.95575:3924 737.50781:7335 790.4071:5234 826.00916:4322 841.70447:4700 857.52887:5421,857.52655,857.52655
M860T589,859.5420787,589.014,1.340691394,0.000121989,0.62062434,NS,0.000752043,-0.688207816,3.913680259,neg,1.733846371,4.313462369,3.201506744,2.774309648,2.40094909,6.675429981,3.908071859,1.917656494,1.272750164,3.429325128,4.00324129,2.273172398,1.980987201,2.886626182,1.780780331,1.50331053,1.846405392,2.050567742,3.410678234,2.588111794,2.232732423,2.857695004,3.779975947,6.032461464,1.783492038,1.690371838,4.991099283,1.56789895,1.855769837,3.909689619,0.660463521,4.356671712,3.659752009,1.14087431,4.925358077,4.438987635,1.70201867,2.003617726,3.20547474,2.153904029,2.179754522,1.794430797,1.97995921,2.319343518,1.783352142,4.395952476,4.39920083,4.309308594,859.537781,859.5463764,Down,PI 36:3|PI 18:1_18:2,S,859.54279,9.817,8817,[M-H]-,C45H81O13P,PI,MXJMOLQIXMJUEL-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCC=CCCCCCCCC,24.9,33.2,859.54279:2163694 860.54614:1290952 861.5495:374063,69.99893:3448 78.95799:424031 79.86224:3983 96.96866:117990 98.50839:3951 134.98483:12481 152.99548:257058 153.99942:9859 167.13733:3904 168.04303:8525 171.0069:6104 217.00352:12564 222.9816:7925 223.00209:120005 241.01302:426178 242.0157:24264 246.69395:3993 255.23451:7022 259.02448:45910 279.23462:678337 280.23807:129848 281.25034:763188 282.25385:139391 297.03961:34900 305.56879:4202 315.05069:15205 318.26636:4132 358.48956:5030 415.23001:8177 417.24402:44011 418.24844:14548 435.25317:5599 577.28564:8387 579.29871:31533 580.30188:8109 597.30457:6009 602.02826:5427 728.07404:4666 736.7821:4930 737.46051:6457 762.40625:5377 859.54181:20491,859.54279,859.54279
M860T602,859.5418255,601.907,1.032663752,0.005542462,0.621156245,NS,0.017314266,-0.686971886,2.256297245,neg,1.482457833,3.293776012,2.157431907,7.73613664,3.512403316,7.936170312,6.683990961,1.997079251,1.633964897,3.082987231,3.325084119,1.863763457,1.519943052,2.075648975,1.892050204,1.087675703,1.744548455,3.718270133,2.554604417,7.252075881,1.514294227,1.716575722,6.544594997,4.625792089,1.726563719,2.765874959,2.47678813,3.573781052,1.970160149,5.431046795,1.354214684,4.784117104,2.533603127,1.005294234,4.447891555,4.675762882,1.773767098,1.315998745,3.798227019,1.707799395,1.31585982,1.458367969,1.691715848,3.303437359,3.515894639,2.294514074,4.881785399,3.124539981,859.5375278,859.5461232,Down,PI 36:3|PI 16:0_20:3,S,859.54205,10.022,8816,[M-H]-,C45H81O13P,PI,UIRZYDCTGNCXNQ-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC,22.3,33.8,859.54205:956363 860.5454:597836 861.54876:218891,61.9872:23433 63.89367:3513 68.5993:3683 71.01291:15256 75.00769:7778 78.21613:3282 78.95802:203049 78.97696:3502 85.56396:3841 89.02363:17352 89.62074:3524 96.96879:51890 98.24354:3498 101.02343:9889 107.98541:3242 113.024:6773 115.9194:4381 116.52981:3947 129.09029:3599 134.98465:3936 152.99561:97572 168.04344:27626 169.04559:3725 217.00552:4805 221.46333:3880 223.00182:45175 225.22437:8084 226.22633:7091 241.01305:164076 241.43431:3713 242.01709:5933 255.23433:261582 256.23776:41177 259.02448:14192 271.22958:16203 272.23334:8865 279.23392:34412 280.23807:6218 281.25018:43424 282.25314:7803 283.2662:6177 297.03918:19139 303.23514:7058 304.23846:5229 305.25067:188143 306.25516:38592 315.05161:7444 381.00467:3660 391.22778:11576 392.23325:4344 393.09702:3937 446.18011:3945 449.79706:3835 553.28088:13849 554.28424:4464 606.53595:4476 686.53741:6884 737.32068:4835 859.54694:10253,859.54205,859.54205
M862T651,861.5567513,650.6395,1.366426132,0.000146083,0.721280892,NS,0.000871347,-0.471366891,3.835400171,neg,2.441340113,4.639649565,3.893110211,4.55261325,3.652758177,5.282815508,6.142907533,3.865558564,2.830505585,5.734978781,4.492251032,2.885484462,2.947156857,2.893524228,2.941464959,2.361659485,3.50724239,3.810060376,4.143147773,4.288346738,2.481640667,2.957575576,4.612729474,5.107548062,1.990115871,2.482816574,3.660871136,2.396558324,2.488466972,3.747198117,2.760751451,5.659674731,4.484987718,1.892436765,5.02284382,6.024775925,3.314770665,3.026535075,2.86688001,3.489227942,2.844801987,2.880832713,2.630632091,2.981423982,2.783578656,3.976615488,3.323643608,5.157198495,861.5524436,861.5610591,Ns,PI 36:2|PI 18:0_18:2,S,861.55664,10.851,8843,[M-H]-,C45H83O13P,PI,KZVRAFHIKMDULK-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC,31.9,40.9,861.55664:13691614 862.55999:7359640 863.56335:2198484,62.8787:14693 65.66898:18007 78.95802:2163911 80.29098:16735 89.09981:16193 93.32536:15330 94.27059:17454 96.96877:667862 130.91676:15689 132.98073:16526 134.98492:83151 152.99554:1481622 153.99916:34987 171.00667:28896 219.57654:17921 223.00209:667934 224.00612:36301 241.01314:2569190 242.01654:164393 259.02423:189420 279.23474:4087526 280.23807:773611 282.25308:23393 283.26608:4373768 284.26962:725304 284.3013:39262 285.27426:34579 297.03976:246463 298.04404:27188 315.05087:79248 415.2294:37671 419.25964:363529 420.26331:54572 437.26886:41453 577.28461:57957 581.31537:256696 582.31561:58915 599.32288:56283 737.60693:21567 861.55695:257108,861.55664,861.55664
M864T698,863.5724738,697.5335,1.839427711,5.68E-08,0.543829226,NS,8.63E-07,-0.878774411,7.245668344,neg,3.186830682,7.271114326,5.526453052,8.349635005,6.185412934,6.41956302,7.905790248,3.714151649,2.185399689,3.903936158,7.894224494,6.153564137,3.446272659,4.697925678,3.506477639,4.520313099,4.070641178,2.888974728,8.451495219,8.099999726,2.389470831,4.719966346,4.965893863,9.730207812,3.39471324,2.923775746,5.236466712,5.537074721,2.935273043,6.145922609,2.406699141,11.13587702,9.33149887,3.300919019,6.129809046,6.332514322,3.383816814,3.409265104,6.555273168,3.144722885,3.345359629,2.760607335,4.081396408,3.948295101,3.758856215,6.964796735,6.743258837,6.753571056,863.568156,863.5767917,Down,PI 36:1|PI 18:0_18:1,S,863.57294,11.622,8866,[M-H]-,C45H85O13P,PI,YOBFISPJJWPPTK-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC,28.4,38.1,863.573:1073107 864.57635:998698 865.57971:380042,61.88683:3137 66.1477:3097 69.7861:2962 72.62594:3609 78.958:157482 96.96873:48232 123.10085:3373 134.98503:5613 152.99562:95624 168.04362:9053 208.26985:3939 223.00183:39136 224.07118:5731 241.01311:186186 242.01724:7231 255.23436:68058 259.02402:15900 262.23145:3904 279.23373:7640 281.25034:280241 282.25418:56486 283.26636:288977 284.26929:47257 297.03949:13894 315.05212:9024 327.23654:17274 330.86304:4152 419.25772:20393 420.26349:4266 579.30408:5101 581.31268:16827 810.67786:3853 863.57269:16527,863.57294,863.57294
M867T809,866.6809553,808.874,0.857800354,0.034086224,1.300464673,NS,0.074153122,0.379027209,1.467421111,neg,2.477952496,4.247534463,4.746387787,1.730453767,2.503820791,2.812359695,2.406756632,3.135631778,2.692252475,2.240703954,2.396517085,1.58796835,3.756887093,2.260557606,3.44610451,1.980178389,2.365066969,3.068400474,0.851849662,1.76797034,3.220159495,1.878215917,1.4466618,3.135627817,3.503556868,3.699667846,3.65276741,0.611340531,5.304669333,4.611661667,2.115430633,4.612083927,2.898374574,3.140808849,5.656330722,3.575270765,3.858143568,3.188078289,5.081336225,2.90445998,3.282551179,5.581256674,4.233661672,2.497668814,1.722465752,1.745891015,2.070303767,1.970638604,866.6766219,866.6852887,Ns,HexCer 42:3;O2|HexCer 18:2;O2/24:1,S,866.6814,13.474,8896,[M+CH3COO]-,C48H89NO8,HexCer_NS,JQBPIYGQWYFXMK-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCC,30.5,32.9,866.68121:1004230 867.68456:691279 868.68792:188906,61.24292:3129 61.57289:3566 61.98724:5356 65.85344:4280 70.99582:2974 71.01279:117880 72.99224:8513 73.02857:5446 78.95808:14755 83.01287:7969 85.02858:25615 89.02349:124979 90.02719:3623 95.01302:8339 95.21845:5115 96.4406:3540 101.02356:91820 102.02704:4290 113.02373:51967 119.0343:46865 161.0461:4058 168.04323:8636 168.4677:3769 217.00252:19733 217.33833:4038 235.20717:20856 241.90514:3753 261.22375:8099 269.70905:4149 283.26483:14645 303.2345:12786 347.33368:11028 364.35919:8036 365.34601:12452 366.34512:4977 374.99817:10361 390.37653:68614 391.38113:16828 406.37308:12911 468.86197:4322 547.02509:4379 596.58386:9008 614.59277:10364 644.60474:32212 645.61566:17687 696.47589:4559 737.47876:7180,866.6814,866.6814
M869T852,868.6965367,852.1395,1.403085683,2.00E-05,1.766086893,NS,0.000163921,0.820556327,4.698872226,neg,3.508813226,5.264177568,8.970544723,2.957647693,3.312855344,4.326118658,3.33083052,5.048866746,5.557968221,5.444941309,4.338249064,2.768806131,7.320806293,3.369128965,7.175462666,4.479060755,3.841642401,4.651246259,1.083529788,3.159935421,8.053628757,3.005459505,1.617869939,3.475226144,6.955565757,8.669824013,5.245217165,1.047835092,8.60896853,10.8511406,5.68600312,7.368808993,5.392125751,5.489732507,6.372349413,6.326631665,8.72564036,5.60639545,11.06035458,4.510268751,8.143161082,12.48658493,8.975259486,5.268883437,3.080150877,3.332702827,4.115147033,2.705050418,868.6921933,868.7008802,Up,HexCer 42:2;O2|HexCer 18:2;O2/24:0,S,868.69714,14.199,8918,[M+CH3COO]-,C48H91NO8,HexCer_NS,RVHBZEQSKCGIES-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC,31.9,34.1,868.69696:3487292 869.70031:2530951 870.70367:796038,61.98726:16116 71.01277:190173 72.01603:5842 72.99204:9009 73.0284:13871 78.95799:45973 80.70025:3770 80.89223:4240 83.01305:15507 84.96097:3797 85.02854:36967 87.00796:9221 89.0235:194600 90.0268:9199 91.25968:3945 95.01302:15702 101.02357:148793 102.02694:4987 113.02366:80844 119.03432:77036 131.03433:6830 138.43449:3557 143.03442:4595 168.04298:26822 217.00349:23748 218.00699:4906 219.97824:5714 235.20764:29044 236.21094:4208 258.92462:4786 261.22385:16858 264.23526:6411 283.26547:7063 303.23456:4774 349.3497:34445 366.37756:21575 367.35889:23401 368.36395:7673 374.99393:8261 392.39301:104277 393.35114:5069 393.39545:26517 408.38641:16708 409.38538:4455 598.59998:14717 599.60303:10044 614.59363:12100 616.60742:11410 617.61194:5774 623.9566:3885 640.17761:3893 646.62097:56687 647.62213:23990 737.55951:4730 760.09302:3860 795.64453:13170,868.69714,868.69714
M871T899,870.7125505,898.777,0.052287181,0.917951694,0.984418165,NS,0.943697746,-0.022656816,0.037180172,neg,9.5499354,7.341295915,13.11491146,13.57982066,15.99175477,17.54507152,9.928581718,26.12357296,9.028222742,9.1960503,18.38590246,17.95109232,24.0362017,13.05839804,11.53746863,5.614182534,4.886786398,5.631507736,9.034409049,14.5187804,26.22950948,8.585193232,8.003268244,16.08697317,22.96920342,12.88854825,12.19871081,20.68059116,11.32418213,19.49838913,8.88905226,18.27179772,40.08109876,24.92554949,13.8745957,31.2449452,20.75828537,9.146183367,15.54997904,4.838388385,34.61799601,26.28964093,25.84112754,9.906235009,8.909885126,19.96420146,18.16459959,8.30992994,870.708197,870.7169041,Ns,HexCer 42:1;O2|HexCer 18:1;O2/24:0,S,870.71332,14.976,8943,[M+CH3COO]-,C48H93NO8,HexCer_NS,POQRWMRXUOPCLD-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC,23.1,34.5,870.71289:349624 871.71624:258107 872.7196:84754,61.98723:31285 65.34966:3288 71.01276:63673 72.99188:5239 73.02815:4507 78.95803:145102 82.08504:3611 85.02854:14425 87.0078:4417 87.18925:3377 87.25258:3487 89.02347:73351 95.01305:4541 96.9686:7145 101.02361:45391 113.0237:31668 119.03408:29531 168.04309:100925 184.04022:3666 217.00398:11592 219.97832:9323 237.22366:10850 263.23947:9188 264.88681:3876 270.44089:4787 349.35089:12680 365.38098:4134 366.37646:9422 367.35764:7250 368.948:4571 386.10953:4516 392.39294:42067 393.39673:13034 395.99167:4210 408.38953:4888 546.36646:4038 600.61322:5655 601.62:5941 618.62305:4769 648.63721:25289 649.63763:14178 737.52972:4879 797.65991:34083 798.66437:7634,870.71332,870.71332
M872T608,871.54242,607.93,0.588616398,0.120216396,0.819824349,NS,0.199870391,-0.286613256,0.920036294,neg,2.133307882,2.980181962,3.070800822,5.338961861,4.911420415,3.61515661,3.125453367,2.043923578,2.228700479,3.140226301,2.770789766,2.532680583,2.24294518,2.092461978,3.188467422,2.489781379,2.705631373,1.930991587,2.169894736,5.137048302,2.042178755,2.1034309,4.133178996,4.321992986,1.878368099,3.763886684,2.062604941,2.080775935,2.1749128,8.076386427,2.110702059,3.621014234,2.718780674,1.331813401,4.493199995,4.373737834,1.622882142,1.645587937,3.099651542,1.841287883,1.468279115,2.11922863,1.896491278,2.100035209,3.315798965,1.766108783,6.035797675,2.884188908,871.5380623,871.5467777,Ns,PI 37:4|PI 17:0_20:4,S,871.54248,10.126,8951,[M-H]-,C46H81O13P,PI,NHCUHDJVBAQLLF-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCC,25.5,34.8,871.5426:461399 872.54595:271686 873.54931:83416,61.98728:9248 78.95805:91836 85.73:3384 96.96877:30599 136.11934:3404 152.99559:47207 163.93422:3618 167.5789:3354 207.31924:3755 217.00255:24935 219.97855:6329 220.90146:3733 223.00244:17268 223.60568:3649 241.01329:87287 259.02365:7103 259.24475:8173 269.25037:139389 270.25357:25288 288.353:4910 297.03912:7036 303.2352:71115 304.23853:16842 405.24442:6665 406.2471:4573 567.2998:10394 593.49402:3941 597.73938:3935 599.17816:3918 871.54456:5575,871.54248,871.54248
M882T553,881.527003,552.82,0.836865049,0.035955046,0.733541213,NS,0.077351598,-0.44705007,1.444240146,neg,2.036542702,3.215486436,2.263037098,7.385240751,3.268588971,5.065531055,3.996091111,1.896976327,3.123359936,2.405676421,2.762471636,3.103674191,2.671204946,2.452840444,2.815381802,2.260723515,3.110900935,1.78459224,2.480148974,7.293996357,1.510476015,2.366907164,3.045749094,3.929720285,2.390006269,3.044961076,1.970264149,1.864259133,2.257191223,6.02110161,1.85041285,6.392522883,2.211348866,1.698467811,4.026336319,4.467058112,1.847547845,2.764307928,3.902265517,2.96423171,1.829937401,2.325602966,1.915579328,1.618996344,1.753694022,1.868724596,3.178921688,2.308119688,881.5225954,881.5314107,Ns,PI 38:6|PI 16:0_22:6,S,881.52777,9.204,9048,[M-H]-,C47H79O13P,PI,FPHAZHKZJQOPBU-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC,45.7,18,881.52759:882294 882.53094:541640 883.5343:170601,61.98704:20393 69.85702:3647 70.2806:3512 70.73581:3335 77.83218:3129 78.95801:97507 87.26102:3354 88.56279:3747 96.96883:22368 104.05399:4192 105.03362:3843 134.98473:3724 141.01631:4191 143.99097:6226 152.99564:46198 217.00436:7145 223.00206:22293 224.46104:3734 240.96559:4933 241.01305:99456 242.01439:4695 255.23428:151732 256.23758:24276 259.0231:7082 283.24509:17634 297.03873:6213 308.95258:4003 327.23477:23518 328.23865:4023 383.06009:3817 391.22958:11169 394.46683:3678 446.64401:4452 553.28186:6651 571.2876:4664,881.52777,881.52777
M884T577,883.5426541,577.244,0.636389411,0.142397607,0.853443335,NS,0.228711968,-0.228632726,0.846497309,neg,2.30969944,3.722042625,3.361099883,3.970732138,2.852092544,6.297163261,4.434423888,1.832338366,1.845259447,3.551581791,3.533094805,2.3983752,1.916885335,2.56263465,2.838980095,2.413127812,2.600353866,2.631138933,2.333504916,3.731883621,2.356180777,2.535826252,4.256252182,3.887655452,2.24190645,2.65279586,2.642551025,1.310684953,2.351475326,5.616584826,1.318751879,3.440127194,3.016123269,1.509258734,3.939358945,4.286686249,1.504040713,1.60623071,3.725847849,2.060678665,1.964119036,2.277545969,1.963357262,2.705460529,2.514404439,2.503285787,6.42478885,2.577828837,883.5382364,883.5470718,Ns,PI 38:5|PI 16:0_22:5,S,883.54333,9.62,9072,[M-H]-,C47H81O13P,PI,COCGWLCGPZONJF-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC,21.7,37.5,883.54315:1652538 884.5465:895369 885.54986:277692,61.98732:8310 78.95802:76827 78.96225:6871 81.67149:3731 91.86265:4273 94.53458:3260 96.96868:28825 143.99127:3685 149.20621:4158 152.9955:48074 153.19987:3730 156.269:3633 217.00356:4432 222.14661:3713 223.00232:21935 240.96399:5033 241.01309:88062 255.23439:104500 256.23907:19485 259.02377:6755 281.25076:43834 282.25485:8387 285.26309:4582 297.04163:7418 303.23453:26821 304.23523:4619 315.05038:6242 329.25165:29201 330.255:6162 354.65714:3995 391.23056:7811 463.90393:4194 553.27832:6361 737.31293:5060 796.30383:4705 883.53894:5775,883.54333,883.54333
M884T596,883.5424136,596.226,0.140399259,0.777952449,0.951062926,NS,0.838484117,-0.072387296,0.109046948,neg,1.647729904,2.970369269,3.620249902,7.639751992,4.799958392,4.179858212,3.157086087,2.948403877,2.630899757,4.885068588,2.090472549,2.089485421,2.846237172,2.283986243,1.74502016,2.857636882,3.5702198,2.775213134,2.096500464,7.413461282,1.868089509,2.096841746,6.742404127,2.808990042,2.243620917,10.11874663,2.805163028,1.570934251,1.545907737,9.624440755,1.728548152,3.566951605,4.620561544,1.524868032,3.543136243,2.76123144,2.583539898,3.71347477,4.434194155,2.202415321,1.323637465,4.214034694,1.664702289,1.679312008,2.157484529,1.062271948,4.375386341,2.00642921,883.5379959,883.5468313,Ns,PI 35:0;O2|PI 18:0_17:0;O2,S,883.54315,9.936,9071,[M-H]-,C44H85O15P,OxPI,OMPYUCAFIBGLRP-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCC(O)CCCCCCCCO)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC,20.7,36.9,883.54315:279761 884.5465:151699 885.54986:63810,61.98722:13715 78.95804:61325 90.60928:3975 96.96873:16460 124.10069:3694 127.00063:5115 143.99028:4251 152.99545:24710 217.00423:8656 223.0025:9219 240.9659:5441 241.01312:62845 244.99228:3863 257.22974:6466 259.02423:5819 281.25037:7638 283.23749:6455 283.2659:75266 284.2692:15967 294.94714:4167 301.21964:14698 302.22327:4110 303.23428:7195 315.05139:4819 419.25568:4493 472.34869:3975 474.93921:4506 499.26144:4124 581.31207:5765 756.11639:4805 883.55292:4055,883.54315,883.54315
M885T841,884.6883836,841.204,0.809658351,0.017713333,1.382450015,NS,0.043689674,0.467227318,1.751699709,neg,8.87970569,4.354991529,7.61867835,10.69674202,5.390022736,13.04559133,7.112975415,6.729341201,4.491433917,7.416728416,8.318924477,5.108917805,7.405800019,3.499173465,7.403761223,8.073794567,3.859838749,10.08969123,1.920853124,10.64793298,18.5183695,6.350842561,2.185053675,4.027120506,5.855074653,7.001181952,4.793610012,6.256547586,9.402770545,14.3137814,7.62432958,9.640780404,10.24182406,5.159122245,3.720169468,7.117762061,14.32534663,11.83990441,11.96608383,4.028055337,6.919007344,13.9621221,5.375160794,4.381653684,3.379188868,5.491319475,5.429461542,4.283546789,884.6839601,884.692807,Ns,HexCer 42:2;O3|HexCer 18:1;O2/24:1;O,S,884.69025,14.026,9083,[M+CH3COO]-,C48H91NO9,HexCer_HS,CXNUVUMLRJUUKW-UHFFFAOYSA-N,O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC)C(O)CCCCCCCCCCC=CCCCCCCCCCC,19.7,18.7,884.69025:532704 885.6936:430940 886.69696:0,71.01274:57036 72.98866:3611 72.99193:22060 73.02831:3401 74.02374:3711 78.958:100053 83.0129:4002 85.02859:11902 88.03935:4563 89.02345:67575 91.19097:3268 95.01272:4221 101.02354:52876 102.15182:3728 113.02366:27396 117.96339:3626 119.03398:26856 152.35248:4058 168.04312:57866 209.18996:4375 239.23979:11928 279.23404:16284 280.23859:4920 280.26587:19289 305.2511:8026 311.75354:3749 333.28448:6932 335.33096:20491 336.34061:4887 363.33295:4624 381.34039:4547 406.37054:7351 445.77002:3720 522.39978:3734 644.60132:20775 645.60974:10516 662.61523:12014 663.61841:6487 797.6601:22847,884.69025,884.69025
M886T641,885.5562312,640.643,0.856414751,0.031357397,0.839287443,NS,0.06939174,-0.252763099,1.503659993,neg,2.947026443,4.838374851,3.972315102,4.035768843,3.475287781,2.978784335,4.108537138,2.794027544,2.74592673,4.865826226,4.101284575,2.492225167,3.187072418,2.401286511,3.860373311,3.273423514,4.085103425,3.101406435,3.718460863,3.948774698,2.717063048,2.954362026,2.768430925,4.435385587,2.211084384,3.196742941,2.64798398,1.531700849,2.563949985,3.691070787,2.767506798,3.923311108,3.768200787,2.721619911,4.866895703,5.326505587,3.062423649,2.591973507,3.785119475,3.411867457,2.732318533,2.639961971,2.367781861,2.69990407,1.852103172,2.388040798,2.311336091,4.724448428,885.5518034,885.560659,Ns,PI 38:4|PI 18:0_20:4,S,885.55688,10.676,9093,[M-H]-,C47H83O13P,PI,OJESNYFIPWSOPO-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC,31.3,41.9,885.55688:61209288 886.56023:36110164 887.56359:10516285,61.98721:9941 62.26127:5291 68.4717:5594 68.67981:6040 78.95802:503413 79.55134:5365 86.46767:6250 86.47317:5895 96.9687:156293 100.70263:5626 119.1553:5343 126.04652:7399 134.9845:12643 137.31551:6535 141.017:5530 152.99556:294754 153.99876:7351 171.00713:7130 176.35712:6851 205.19652:12027 212.31335:5649 223.00215:126222 224.00333:7062 241.01311:553860 242.01659:25640 251.11938:6900 259.0242:52960 259.24478:56852 260.24832:9486 281.2547:6044 283.26608:914188 284.26935:163638 297.03943:53142 303.23495:420263 303.28708:8566 304.23798:90972 315.05133:30717 336.09079:5418 354.34503:6325 419.25983:52756 420.2641:15270 447.93207:6562 581.31329:39776 582.31635:9243 599.3266:19312 601.28613:10489 707.91058:7049 885.55701:45061,885.55688,885.55688
M888T667,887.5732193,666.566,1.303844578,0.000455979,0.640724763,NS,0.002265398,-0.642223345,3.341054863,neg,1.72475552,4.846980928,3.13881805,7.12649224,3.79768782,5.266260785,5.703027107,3.143725897,2.313271264,4.568356623,5.455350723,1.719854342,2.384392243,2.41699801,2.780774003,1.513385722,2.981176838,5.602295424,4.799455504,6.906891774,2.471816059,2.073777724,4.040400488,4.07241387,1.817553931,3.63362824,2.23285847,4.749673575,1.881785664,3.908017085,1.831815916,4.598792499,4.053292193,1.711276264,5.709669815,4.928307637,2.646497046,1.941613297,3.970167677,2.298787054,2.27229375,2.215536506,1.900722325,3.553071334,2.843979248,2.629658617,2.208542704,5.678029141,887.5687814,887.5776571,Down,PI 38:3|PI 18:0_20:3,S,887.57373,11.12,9120,[M-H]-,C47H85O13P,PI,GGSSNEAFVQRIHU-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC,29.3,38.8,887.5741:4618282 888.57745:2778231 889.58081:958977,61.98723:5681 66.17219:3007 72.69348:3440 78.95384:4424 78.958:130389 79.1623:3907 79.31425:3234 96.96883:30909 111.45076:3754 120.42133:4032 122.4442:4361 127.68484:3887 144.44275:3617 152.99551:71575 168.04291:14937 223.00264:31216 241.01311:125158 242.01738:9086 255.23499:4688 259.0239:11043 283.2662:204725 284.26971:44018 285.27094:4054 297.03986:12184 303.23483:14307 305.25085:128465 306.25388:24016 419.26016:15290 581.31555:10624 599.32996:6996 737.21936:5959 887.57776:9472,887.57373,887.57373
M910T623,909.558356,622.824,1.096645298,0.005360505,0.67732404,NS,0.016874104,-0.562081894,2.270794304,neg,2.016022004,3.459395725,2.284585146,7.538609132,3.893999702,3.909340154,3.867381117,1.82935008,3.210737875,2.756894469,3.174529282,3.526572761,2.814579463,2.37636368,3.183003575,2.863681518,4.051582992,1.675420672,3.385357137,7.298921823,1.757405656,2.485709918,2.139960813,4.752387587,2.303576027,3.234719535,2.68840269,1.777056942,2.064132154,5.352350348,2.268847135,5.413149056,3.132015575,1.84564074,4.993946263,4.841728314,2.078758564,2.658214328,3.362855468,3.179775991,2.097156654,2.113971,1.633831136,1.577138431,1.503689964,1.83283614,1.772985398,2.718245003,909.5538082,909.5629038,Ns,SMGDG O-41:6|SMGDG O-19:0_22:6,S,909.55896,10.369,9337,[M-H]-,C50H86O12S,EtherSMGDG,CMPSAZZUDCJBEA-UHFFFAOYSA-N,O=C(OC(COCCCCCCCCCCCCCCCCCCC)COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)CCC=CCC=CCC=CCC=CCC=CCC=CCC,5,75,909.55908:2564264 910.56243:1567542 911.56579:492587,65.6076:3408 70.18764:3420 78.95802:151276 96.96867:37979 121.10136:3695 126.99932:3904 150.87578:3797 152.99547:87732 192.16801:3674 198.01007:3558 223.0022:38686 227.20248:4437 229.1983:6565 241.01318:145277 242.01662:9240 259.02328:12309 283.26706:236212 284.27005:49171 292.91595:3897 297.03943:15505 315.05182:9773 327.2348:35137 328.23767:7198 362.77966:4195 419.25928:14456 463.23172:3932 581.31659:7622 582.31531:3887 599.32916:4414 737.59631:6667 743.81232:4364 909.55463:12884,909.55896,909.55896
M912T642,911.5729685,641.745,0.532625287,0.191311278,0.865689458,NS,0.289067861,-0.208078504,0.718259427,neg,2.605295868,2.932115477,4.452818602,5.600290776,3.422146306,4.560956664,6.046012732,2.678068257,2.842707494,4.534146715,3.292994255,3.291648161,2.570587365,2.110650874,3.580565172,3.489294397,5.060013372,3.301734242,3.345735707,5.622978126,2.445771556,1.913266916,3.644977288,3.493029269,2.859836134,4.041659291,2.019741244,1.48733435,2.071962055,4.167887194,2.560508491,3.712500941,2.57256309,2.069166669,4.565297021,5.369483652,2.299698108,2.827067788,4.609747332,2.638365269,2.29303447,2.809197327,1.748302488,1.88899588,1.539366822,1.997344191,2.509940121,3.740693693,911.5684106,911.5775263,Ns,PI 40:5|PI 18:0_22:5,S,911.57318,10.688,9359,[M-H]-,C49H85O13P,PI,QLABQLNIHHHJCI-UHFFFAOYSA-N,O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC,23.4,31.3,911.57318:1068363 912.57653:645200 913.57989:208467,78.95801:106099 82.88584:3695 96.96864:30884 120.66382:3754 127.00069:6845 140.59846:3598 149.73764:3469 152.99545:66425 218.32916:3663 223.00188:24414 241.01311:108740 242.01752:6001 259.02368:10570 283.26611:161402 284.26907:27037 285.2616:5369 297.03976:8420 303.23627:6953 309.28226:17237 310.28452:4658 315.05322:5564 329.25015:59895 330.25504:9949 419.2605:10519 581.31464:7546 582.31952:4319 911.56866:4375,911.57318,911.57318
M914T683,913.5888031,682.959,0.675159174,0.081773925,0.870433731,NS,0.146917351,-0.20019363,1.087385157,neg,2.440298388,4.968997822,4.435942599,4.117094279,4.418056682,5.449103199,5.918910533,3.8835449,2.449861707,4.509149488,5.13418193,2.966482469,2.784101363,2.413885913,3.704905721,2.955333333,3.676338424,5.292622973,4.439308107,3.695538059,2.487810836,2.591421151,3.825007277,4.485301222,2.155786598,3.59639359,2.475930588,3.835383302,3.176186169,6.266418505,2.982707255,5.134876029,4.334362662,3.402498177,4.962430109,5.005058911,4.157953707,2.107298142,4.606457683,3.258270657,3.521396406,3.018677776,3.491339603,4.353145431,3.020976968,2.74275038,3.171811943,4.888326931,913.5842352,913.5933711,Ns,SMGDG O-41:4|SMGDG O-19:0_22:4,S,913.58893,11.383,9387,[M-H]-,C50H90O12S,EtherSMGDG,KVBRGHLGETYWHE-UHFFFAOYSA-N,O=C(OC(COCCCCCCCCCCCCCCCCCCC)COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)CCCCCCCCC=CCC=CCC=CCC=CCC,3.9,75,913.58978:252869 914.59313:149047 915.59649:60818,66.36935:3176 75.23094:3258 77.85927:3449 78.95796:48444 78.96207:3807 87.28561:3657 96.96889:13180 97.56303:3684 105.37128:3158 152.45168:4055 152.99551:36379 223.00224:13105 241.01332:64590 259.02185:4041 283.26596:112254 284.2691:17013 297.03857:8454 331.26678:50872 332.27026:5787 419.25723:7262 581.30475:6100 737.56805:4735 913.58325:4432,913.58893,913.58893