,Analyte,Similarity,R.T. (minutes),Count,,SG-1,,,,SG-2,,,,SG-3,,,,QG-1,,,,QG-2,,,,QG-3,,,,RG-1,,,,RG-2,,,,RG-3,,,
Peak,NA,NA,Average,NA,Mass,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area,Class,R.T. (minutes),NA,Area
Analyte 1,1,0,1.537,9,28,Class2,1.536,0,147986.375,Class2,1.536,0,176183.075,,0,0,,Class3,1.532,0,242660.58,,0,0,,Class3,1.541,0,435440.078,Class4,1.545,0,343907.554,Class4,1.545,0,311676.233,Class4,1.527,0,355156.228
Analyte 3,2,0,1.627,12,46,Class2,1.621,0,31040.023,Class2,1.621,0,29724.204,Class2,1.625,0,42409.031,Class3,1.621,0,50237.817,Class3,1.638,0,118525.95,Class3,1.634,0,145940.38,Class4,1.63,0,37121.553,Class4,1.634,0,236320.826,Class4,1.621,0,94392.747
Analyte 4,3,0,1.661,6,60,,0,0,,Class2,1.692,0,1242.644,,0,0,,,0,0,,,0,0,,Class3,1.67,0,2676.061,Class4,1.643,0,13099.785,Class4,1.648,0,19636.278,,0,0,
"Benzyl alcohol, (1-(dimethylamino)ethyl)-",4,538,1.693,4,33,Class2,1.692,581,20600.496,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,1.701,521,21335.515,,0,0,,,0,0,
"Undecane, 2,2-dimethyl-",5,711.3333,1.759,12,57,Class2,1.754,761,44588.835,Class2,1.758,553,36200.568,Class2,1.758,826,55756.484,Class3,1.75,692,45268.776,Class3,1.767,678,23450.875,Class3,1.763,681,35334.873,Class4,1.763,699,33917.82,Class4,1.767,732,51621.014,Class4,1.758,676,29033.878
"Disiloxane, hexamethyl-",6,948.9167,1.809,12,147,Class2,1.803,969,361639.012,Class2,1.803,958,168490.861,Class2,1.807,953,611959.725,Class3,1.803,929,385137.202,Class3,1.812,935,175997.143,Class3,1.816,930,244200.026,Class4,1.816,935,211750.744,Class4,1.816,968,432818.594,Class4,1.807,944,421330.931
Chloromethane,7,489.5455,1.889,12,47,Class2,1.887,0,54764.174,Class2,1.883,644,144147.532,Class2,1.883,644,280214.243,Class3,1.883,644,388726.678,Class3,1.892,644,343523.237,Class3,1.896,484,84683.604,Class4,1.896,325,33295.761,Class4,1.896,447,55749,Class4,1.887,382,50467.56
"1,3-Dioxolane, 2-pentadecyl-",8,745.7,1.911,10,73,Class2,1.909,729,26098.723,,0,0,,Class2,1.905,841,45376.56,Class3,1.901,735,39554.94,Class3,1.918,685,21932.115,Class3,1.918,835,30473.143,,0,0,,Class4,1.919,647,40859.534,Class4,1.91,666,29212.181
Analyte 10,9,0,1.94,12,43,Class2,1.936,0,25196317.1,Class2,1.936,0,28147995.6,Class2,1.936,0,19316419.1,Class3,1.936,0,20222166.4,Class3,1.945,0,26976177,Class3,1.945,0,24726213.1,Class4,1.945,0,23726667.5,Class4,1.945,0,28575437.3,Class4,1.936,0,3565980.97
Analyte 11,10,661,1.951,3,59,,0,0,,Class2,1.954,661,25163.61,Class2,1.94,0,3122.489,,0,0,,,0,0,,Class3,1.958,0,2416.233,,0,0,,,0,0,,,0,0,
Carbon disulfide,11,745.3636,2.045,11,76,Class2,2.043,611,44494.281,Class2,2.038,732,44472.072,Class2,2.043,772,112599.621,Class3,2.038,839,105050.115,Class3,2.056,662,53638.286,Class3,2.052,877,92223.854,,0,0,,Class4,2.047,634,20197.824,Class4,2.047,739,72931.736
"Disiloxane, 1-ethenyl-1,1,3,3-tetramethyl-3-(2-propenyl)-",12,632.75,2.143,8,131,Class2,2.136,518,4421.075,,0,0,,Class2,2.136,730,11231.787,Class3,2.145,547,6448.854,,0,0,,Class3,2.154,446,2358.863,Class4,2.149,607,1639.52,,0,0,,Class4,2.14,714,8112.201
"1-Butanol, 3-methyl-, carbonate (2:1)",13,593.4,2.172,5,70,Class2,2.172,682,44579.35,Class2,2.167,747,174955.676,,0,0,,,0,0,,,0,0,,Class3,2.181,551,32223.664,,0,0,,Class4,2.176,506,46551.925,,0,0,
4-Methylpentyl pentanoate  #,14,618,2.206,3,85,,0,0,,Class2,2.198,738,43029.033,Class2,2.203,538,17573.02,,0,0,,,0,0,,,0,0,,,0,0,,Class4,2.216,578,11275.156,,0,0,
Analyte 16,15,0,2.281,5,34,,0,0,,Class2,2.274,0,10834.897,,0,0,,Class3,2.261,0,24489.962,,0,0,,,0,0,,,0,0,,Class4,2.292,0,625.008,Class4,2.292,0,11083.082
Dothiepin,16,837.5455,2.306,11,58,Class2,2.3,859,3131741.09,Class2,2.3,828,924901.61,Class2,2.3,816,830520.597,,0,0,,Class3,2.309,842,485922.352,Class3,2.314,847,2799697.24,Class4,2.309,847,1265557.36,Class4,2.314,849,6719555.77,Class4,2.3,799,209041.165
2-Pentoxy-tetrahydropyran,17,657.5,2.367,10,114,Class2,2.367,623,13137.788,Class2,2.358,576,13894.669,,0,0,,Class3,2.363,516,8355.964,Class3,2.367,693,10755.339,,0,0,,Class4,2.376,666,10921.668,Class4,2.376,724,24127.482,Class4,2.363,719,24126.403
"Heptane, 2,4-dimethyl-",18,694.3,2.428,10,84,Class2,2.425,731,162140.607,Class2,2.425,745,553972.524,Class2,2.425,736,459092.546,Class3,2.425,648,78215.046,,0,0,,Class3,2.434,747,146991.738,Class4,2.434,554,17081.438,Class4,2.434,736,211730.027,Class4,2.425,700,50816.855
"N,N Dimethyl-3,4-methylenedioxyamphetamine",19,813.6364,2.445,12,72,Class2,2.442,815,235921.03,Class2,2.438,870,170338.431,Class2,2.442,680,263680.138,Class3,2.438,889,196835.133,Class3,2.447,908,113415.697,Class3,2.452,0,518818.53,Class4,2.456,828,308505.705,Class4,2.452,853,562271.403,Class4,2.438,764,310762.049
(2-Hydroxyethyl)trimethylammonium bromide,20,787.625,2.461,8,58,,0,0,,Class2,2.456,679,284378.533,Class2,2.46,818,605284.291,Class3,2.456,763,455559.908,Class3,2.469,999,281123.728,Class3,2.478,603,723314.193,,0,0,,,0,0,,Class4,2.46,718,223269.52
unknown,21,734.8333,2.562,12,74,Class2,2.558,734,2599760.34,Class2,2.558,735,5475926.84,Class2,2.558,735,3604984.43,Class3,2.558,735,2907429.14,Class3,2.567,734,4469316.36,Class3,2.571,737,2231727.15,Class4,2.567,735,3677260.09,Class4,2.571,735,3932760.37,Class4,2.558,735,4741761.82
"L-Proline, ethyl ester",22,498.4286,2.66,7,27,,0,0,,Class2,2.727,499,21252.291,Class2,2.696,389,73824.615,Class3,2.603,480,17712.311,,0,0,,Class3,2.66,741,15154.657,Class4,2.625,462,19391.42,,0,0,,,0,0,
Aminoacetonitrile,23,624.8,2.701,10,56,,0,0,,Class2,2.705,616,27307.572,Class2,2.7,588,105491.122,Class3,2.696,716,146816.126,Class3,2.705,691,74460.701,Class3,2.709,569,19782.725,,0,0,,Class4,2.709,558,26023.156,Class4,2.691,519,16774.677
"Cyclotrisiloxane, hexamethyl-",24,983,2.775,12,207,Class2,2.767,987,5051330.96,Class2,2.767,994,12275902.8,Class2,2.767,995,5489034.2,Class3,2.771,988,30788851.7,Class3,2.784,992,32780203,Class3,2.785,995,31750850.7,Class4,2.785,992,30544923,Class4,2.78,995,28322578.2,Class4,2.776,981,30754314.6
"Octane, 4-methyl-",25,631.1667,2.837,6,84,Class2,2.833,580,109434.266,Class2,2.833,736,390723.886,Class2,2.833,687,146737.188,,0,0,,,0,0,,Class3,2.847,566,43987.391,,0,0,,Class4,2.842,684,192863.73,,0,0,
"Trisiloxane, octamethyl-",26,885.5833,2.849,12,73,Class2,2.847,829,389011.645,Class2,2.842,927,239382.713,Class2,2.847,947,434018.849,Class3,2.842,941,385612.098,Class3,2.856,890,243938.652,Class3,2.856,907,299484.397,Class4,2.856,824,263579.333,Class4,2.856,807,388467.125,Class4,2.842,909,375544.772
"3-Butene-1,2-diol, 1-(2-furanyl)-",27,690.375,3.072,8,97,Class2,3.024,736,6323.384,Class2,3.091,779,3454.357,Class2,3.135,644,3204.429,Class3,3.029,633,6217.7,,0,0,,Class3,3.073,711,5001.929,,0,0,,Class4,3.176,690,2310.714,,0,0,
"Indole, 3-methyl-2-(2-dimethylaminopropyl)-",28,784.8182,2.999,11,72,Class2,2.993,733,397195.564,Class2,2.989,753,504439.686,Class2,2.998,823,1411721.29,Class3,2.993,835,1116394.74,Class3,3.002,765,1857351.51,Class3,3.007,767,467157.517,Class4,3.007,814,203406.905,Class4,3.007,819,1177578.52,,0,0,
"2-Fluoro-5-trifluoromethylbenzoic acid, nonyl ester",29,558.25,3.101,5,28,,0,0,,,0,0,,Class2,3.091,515,290012.094,Class3,3.096,709,127275.531,Class3,3.1,0,336205.626,Class3,3.109,388,289297.391,Class4,3.109,621,333922.727,,0,0,,,0,0,
Ethyl Acetate,30,602.75,3.149,4,89,Class2,3.144,607,7862779.03,,0,0,,,0,0,,Class3,3.145,603,4698595.77,Class3,3.158,601,11475515,,0,0,,,0,0,,,0,0,,Class4,3.149,600,9224032.83
"Pyrrolidine-2-carboxamide, N-heptyl-N-methyl-",31,502.5,3.139,12,89,Class2,3.122,471,906571.631,Class2,3.153,470,13460466.9,Class2,3.144,488,3733373.07,Class3,3.122,557,657325.878,Class3,3.122,460,534480.701,Class3,3.158,482,7202350.67,Class4,3.158,464,9111378.03,Class4,3.149,456,1398087.08,Class4,3.113,485,503761.172
unknown,32,532.25,3.177,4,72,,0,0,,Class2,3.176,564,295543.761,,0,0,,,0,0,,Class3,3.184,519,459873.932,Class3,3.171,530,327500.481,,0,0,,,0,0,,Class4,3.175,516,330985.103
"Furan, 3-methyl-",33,769.5,3.235,4,82,,0,0,,,0,0,,Class2,3.238,789,62377.802,,0,0,,,0,0,,Class3,3.247,758,49101.278,,0,0,,,0,0,,,0,0,
Fenproporex,34,610.5,3.288,3,144,Class2,3.291,825,735.956,,0,0,,Class2,3.286,0,390.254,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,3.287,396,0
Analyte 36,35,794,3.286,12,31,Class2,3.282,0,14865057.1,Class2,3.282,0,14511832.8,Class2,3.282,0,15607064.5,Class3,3.282,0,15977319.8,Class3,3.295,794,14032089.8,Class3,3.291,0,14463175.6,Class4,3.291,0,15365050.7,Class4,3.291,0,18681029.3,Class4,3.282,0,12362197
Trifluoromethyldifluorophosphine,36,642.5714,3.276,7,69,Class2,3.309,564,12725,Class2,3.313,688,7022.714,Class2,3.193,588,13305.655,,0,0,,Class3,3.371,724,4167.558,Class3,3.224,593,9027.5,Class4,3.282,739,6758.6,,0,0,,Class4,3.238,602,33399.732
"Ethanone, 1,2-di-2-furanyl-2-hydroxy-",37,598,3.299,4,97,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,3.26,473,2677.192,,0,0,,Class4,3.269,593,6093.905,Class4,3.335,685,1901.895
"Cyclotrisiloxane, hexamethyl-",38,855.6364,3.398,12,59,Class2,3.398,0,176737.345,Class2,3.393,842,68161.747,Class2,3.393,759,56904.824,Class3,3.393,876,105766.935,Class3,3.402,883,50411.104,Class3,3.407,882,131324.93,Class4,3.398,858,65270.653,Class4,3.407,881,114852.917,Class4,3.393,871,63536.093
"4,4'-bi-4H-pyran, 2,2',6,6'-tetrakis(1,1-dimethylethyl)-4,4'-dimethyl-",39,703.25,3.395,4,69,Class2,3.415,626,14041.619,Class2,3.406,807,0,,0,0,,,0,0,,Class3,3.384,693,0,,0,0,,,0,0,,,0,0,,Class4,3.375,687,0
"Butanal, 2-methyl-",40,683.0833,3.483,12,57,Class2,3.482,677,844408.935,Class2,3.478,683,326253.661,Class2,3.482,684,406072.644,Class3,3.487,628,317223.511,Class3,3.486,608,262167.147,Class3,3.482,692,1181794.97,Class4,3.487,718,797186.587,Class4,3.487,704,1159869.88,Class4,3.482,715,751610.863
Silacyclopentane,41,652.6667,3.551,12,39,Class2,3.549,663,973795.323,Class2,3.549,629,152004.605,Class2,3.544,643,166981.523,Class3,3.544,640,152002.678,Class3,3.557,663,56752.733,Class3,3.558,660,1243286.91,Class4,3.558,669,615663.361,Class4,3.558,660,1104603.48,Class4,3.549,639,226410.804
Analyte 43,42,538.6667,3.929,12,46,Class2,3.922,0,3511685.08,Class2,3.922,0,11903919.7,Class2,3.926,0,20374593.1,Class3,3.926,0,25693094.7,Class3,3.935,0,20242063.8,Class3,3.935,0,7412464.8,Class4,3.935,0,8174971.45,Class4,3.935,0,15766760.7,Class4,3.926,0,16629352.5
Benzene,43,820.3333,3.948,9,78,Class2,3.944,886,94348.955,Class2,3.944,709,80346.364,Class2,3.944,689,71460.275,Class3,3.949,825,54223.092,Class3,3.957,885,181682.206,,0,0,,Class4,3.953,885,75080.576,Class4,3.953,882,127336.179,Class4,3.944,716,109000.939
"1-Ethoxy-2,2,3,3,-tetramethylaziridine",44,529.8,4.018,5,98,,0,0,,Class2,4.006,530,12259.41,,0,0,,,0,0,,,0,0,,Class3,4.024,510,23960.007,Class4,4.02,492,17215.83,Class4,4.024,621,57984.29,Class4,4.015,496,15701.137
"Furan, 2-ethyl-",45,835.9167,4.216,12,81,Class2,4.21,871,120825.93,Class2,4.21,808,40342.901,Class2,4.21,847,59287.821,Class3,4.206,795,77197.651,Class3,4.219,749,29432.164,Class3,4.224,749,131835.015,Class4,4.224,816,62467.24,Class4,4.228,849,233722.796,Class4,4.21,841,109025.63
"Propanoic acid, ethyl ester",46,730.5,4.326,12,102,Class2,4.321,839,634905.463,Class2,4.322,837,1178298.85,Class2,4.321,843,397523.969,Class3,4.322,614,288424.007,Class3,4.33,813,1045895.09,Class3,4.33,834,406216.134,Class4,4.331,828,876980.665,Class4,4.331,739,124816.126,Class4,4.322,834,748130.63
"Heptane, 2,2,4,6,6-pentamethyl-",47,841.1667,4.363,12,56,Class2,4.361,843,995620.051,Class2,4.353,803,913380.494,Class2,4.361,867,1460992.07,Class3,4.353,860,1094608.8,Class3,4.366,781,666816.211,Class3,4.37,853,641575.81,Class4,4.375,842,683448.652,Class4,4.371,860,910561.051,Class4,4.362,868,895986.742
"1-(1,1-Dioxo-tetrahydro-1.lambda.(6)-thiophene-3-sulfonyl)-piperidine",48,670.3333,4.467,3,84,,0,0,,,0,0,,Class2,4.464,672,51713.128,Class3,4.464,699,93161.287,Class3,4.472,640,44992.513,,0,0,,,0,0,,,0,0,,,0,0,
"2,2-Dimethyl-3-oxopentanoic acid, ethyl ester",49,496.8571,4.514,8,71,Class2,4.512,538,196697.57,Class2,4.513,499,326180.434,Class2,4.504,0,167935.317,Class3,4.513,432,75927.897,Class3,4.517,539,587915.603,Class3,4.517,474,182995.525,Class4,4.522,508,385979.152,,0,0,,Class4,4.513,488,229732.483
Trimethylsilylmethanol,50,657.9167,4.685,12,61,Class2,4.681,603,3223663.17,Class2,4.681,655,5163606.4,Class2,4.681,660,3741136.87,Class3,4.681,691,2066356.93,Class3,4.69,653,4977010.97,Class3,4.69,637,2583990.97,Class4,4.69,660,4094558.34,Class4,4.69,649,3953240.58,Class4,4.681,681,5549421.17
"Benzimidazol-2-amine, 1-(2-diethylaminoethyl)-",51,723.0833,4.713,12,86,Class2,4.695,639,67841.642,Class2,4.717,598,734202.718,Class2,4.717,665,1163996.98,Class3,4.704,815,3296638.87,Class3,4.721,789,1208273.39,Class3,4.726,824,675833.069,Class4,4.721,842,798533.165,Class4,4.721,749,1995264.5,Class4,4.704,999,7786632.64
"Heptanal, 2-methyl-",52,670.1818,4.733,11,44,Class2,4.73,656,1091446.6,Class2,4.721,758,867301.467,Class2,4.73,865,848906.638,Class3,4.726,586,933376.798,Class3,4.735,645,667226.931,Class3,4.739,602,1346350.62,Class4,4.735,623,536133.648,Class4,4.739,588,1295201.09,,0,0,
unknown,53,668.1667,4.921,12,74,Class2,4.917,649,78112.253,Class2,4.912,726,429272.975,Class2,4.917,654,79568.663,Class3,4.917,665,79750.179,Class3,4.921,678,231871.163,Class3,4.926,583,36592.546,Class4,4.926,699,196938.05,Class4,4.926,511,79237.186,Class4,4.917,757,121484.442
"1-Methoxy-6,6-dimethyl-cyclohex-2-ene",54,572.4,5.01,5,84,,0,0,,,0,0,,Class2,5.01,580,49353.941,,0,0,,Class3,5.019,483,17551.044,,0,0,,,0,0,,Class4,5.01,532,17055.866,,0,0,
Analyte 56,55,546,5.228,12,41,Class2,5.223,0,535986.075,Class2,5.223,524,452723.726,Class2,5.228,485,580490.25,Class3,5.223,807,768749.746,Class3,5.232,332,455334.095,Class3,5.237,567,603363.817,Class4,5.232,567,727397.035,Class4,5.232,567,589939.614,Class4,5.223,519,624456.155
unknown,56,677.5,5.285,12,85,Class2,5.285,734,54284.331,Class2,5.285,725,169490.196,Class2,5.281,579,84925.279,Class3,5.281,680,55760.232,Class3,5.285,586,44104.554,Class3,5.281,619,42592.854,Class4,5.29,674,38135.442,Class4,5.29,728,125228.666,Class4,5.285,671,123912.826
unknown,57,796.6667,5.466,3,144,Class2,5.445,712,473.872,Class2,5.454,811,0,,0,0,,,0,0,,,0,0,,,0,0,,Class4,5.499,867,0,,0,0,,,0,0,
"Cyclotetrasiloxane, octamethyl-",58,947.4167,5.444,12,179,Class2,5.441,948,118007.913,Class2,5.436,942,112927.519,Class2,5.445,956,146665.329,Class3,5.441,932,94490.904,Class3,5.445,953,86164.005,Class3,5.45,961,237103.732,Class4,5.45,936,122690.723,Class4,5.45,958,107364.628,Class4,5.441,899,142731.865
"benzenamine, 4-[2-(2,5-dimethoxyphenyl)ethyl]-N-ethyl-",59,702.6,5.496,5,134,,0,0,,,0,0,,Class2,5.459,645,10223.694,,0,0,,Class3,5.45,759,9162.857,Class3,5.548,613,13445.222,,0,0,,Class4,5.552,760,4139.053,,0,0,
"Butanoic acid, 2-methyl-, methyl ester",60,676.5714,5.499,7,88,,0,0,,Class2,5.494,867,256965.276,,0,0,,,0,0,,Class3,5.503,441,294877.628,,0,0,,,0,0,,Class4,5.503,706,196533.794,Class4,5.494,830,275464.059
"Octane, 3,5-dimethyl-",61,576,5.561,5,113,Class2,5.565,591,29328.686,Class2,5.552,672,89891.582,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,5.574,624,55294.867,,0,0,
Isobutyl acetate,62,690,5.601,12,56,Class2,5.596,696,3617959.8,Class2,5.596,705,6097647.3,Class2,5.601,693,4899887.29,Class3,5.597,665,2777454,Class3,5.605,699,8731945.97,Class3,5.605,689,2724890.69,Class4,5.605,707,5051917.42,Class4,5.605,687,6825128.29,Class4,5.596,700,7436932.98
1-Penten-3-one,63,560.1,5.728,10,93,Class2,5.73,614,65373.675,,0,0,,Class2,5.734,580,88966.578,Class3,5.725,424,56850.689,Class3,5.734,406,27512.793,,0,0,,Class4,5.734,514,33116.018,Class4,5.734,486,40585.291,Class4,5.721,497,16010.886
tert-Butyldimethylsilanol,64,598.75,6.061,12,81,Class2,6.054,670,121749.622,Class2,6.049,465,56885.696,Class2,6.058,629,89496.186,Class3,6.054,555,128205.93,Class3,6.067,373,46979.561,Class3,6.072,498,199916.679,Class4,6.063,712,108718.514,Class4,6.067,543,312204.168,Class4,6.054,455,127784.246
"Cyanamide, dimethyl-",65,685.8333,6.193,12,70,Class2,6.187,523,586830.121,Class2,6.192,721,90717521.1,Class2,6.191,651,59837231.5,Class3,6.187,676,69361497.9,Class3,6.196,725,123375201,Class3,6.201,624,10183561.2,Class4,6.196,640,10494275.9,Class4,6.201,639,22329715.4,Class4,6.187,768,193769.204
"Butanoic acid, ethyl ester",66,676.5,6.221,10,88,Class2,6.214,730,2945618.46,Class2,6.218,682,2973064.48,Class2,6.223,610,531836.329,Class3,6.223,658,940481.488,Class3,6.227,749,5510069.99,Class3,6.227,702,1868198,Class4,6.227,754,2162488.71,,0,0,,Class4,6.218,653,1612196.28
unknown,67,592.1667,6.355,6,85,Class2,6.351,539,72312.775,Class2,6.356,539,75455.547,Class2,6.356,611,86987.435,,0,0,,,0,0,,,0,0,,,0,0,,Class4,6.356,677,126772.109,Class4,6.352,601,125302.093
Allyl fluoride,68,650.2,6.379,10,31,Class2,6.378,465,186781.471,Class2,6.369,730,262725.132,Class2,6.378,527,511761.233,Class3,6.374,713,860840.603,Class3,6.383,766,357070.308,Class3,6.383,631,191069.814,Class4,6.383,700,263641.252,Class4,6.378,761,1160588.34,Class4,6.378,761,1419812
"Hexane, 1-(hexyloxy)-3-methyl-",69,590.6667,6.646,6,84,,0,0,,Class2,6.64,647,74532.624,Class2,6.649,552,10301.3,Class3,6.649,509,9515.699,,0,0,,,0,0,,,0,0,,Class4,6.649,609,21969.223,Class4,6.645,582,44562.959
"Butanoic acid, 2-methyl-, ethyl ester",70,779.7,6.67,10,102,Class2,6.667,854,1461438.51,Class2,6.667,782,1361782.51,Class2,6.667,686,328756.331,Class3,6.667,724,445065.789,Class3,6.676,832,3742775.96,Class3,6.676,859,1533346.48,Class4,6.676,860,1890643.45,Class4,6.676,680,120331.623,Class4,6.667,851,609792.514
"Decane, 4-methyl-",71,623.25,6.744,4,71,,0,0,,Class2,6.742,625,181907.946,Class2,6.747,583,37881.993,,0,0,,,0,0,,,0,0,,,0,0,,Class4,6.747,548,100384.738,Class4,6.738,737,105879.052
"Thiophene, 2-(1,1-dimethylethoxy)-",72,685.2727,6.816,11,100,Class2,6.818,612,34236.886,Class2,6.809,698,241789.23,Class2,6.809,678,117311.013,Class3,6.814,579,136404.497,Class3,6.822,698,164027.015,Class3,6.814,678,86465.386,Class4,6.818,637,42308.602,Class4,6.823,727,178112.147,,0,0,
unknown,73,615.8333,7.053,12,281,Class2,7.058,587,21542.023,Class2,7.049,623,22683.261,Class2,7.053,519,20209.02,Class3,7.049,532,27355.245,Class3,7.058,518,19473.768,Class3,7.049,680,19369.639,Class4,7.053,576,22729.257,Class4,7.053,613,23675.743,Class4,7.049,609,21198.18
"Disulfide, dimethyl",74,650,7.072,8,94,,0,0,,Class2,7.067,760,160414.92,Class2,7.071,838,6009227.6,Class3,7.067,772,231135.689,Class3,7.075,684,146743.275,,0,0,,,0,0,,Class4,7.076,584,33376.138,Class4,7.071,477,30071.178
"Butanoic acid, 3-methyl-, ethyl ester",75,679,7.091,6,85,Class2,7.093,711,42285.901,Class2,7.089,685,51563.387,,0,0,,Class3,7.089,476,19276.685,Class3,7.093,776,156603.051,Class3,7.093,688,49753.157,Class4,7.089,738,85326.023,,0,0,,,0,0,
"Acetic acid, butyl ester",76,724.3333,7.192,12,61,Class2,7.191,722,4628656.5,Class2,7.191,728,7267003.6,Class2,7.191,726,3645002.8,Class3,7.187,729,3162247.31,Class3,7.195,727,8831394.39,Class3,7.196,730,3253568.9,Class4,7.196,730,4445895.55,Class4,7.196,721,5571178.35,Class4,7.191,736,7247447.47
Hexanal,77,717.1667,7.383,12,82,Class2,7.382,727,790556.602,Class2,7.378,718,777231.18,Class2,7.382,735,554289.095,Class3,7.382,718,407653.522,Class3,7.386,725,546976.284,Class3,7.387,731,968024.497,Class4,7.382,710,518296.457,Class4,7.387,731,1183899.22,Class4,7.378,622,120472.685
"Dodecane, 2,6,10-trimethyl-",78,633.3333,7.468,9,85,Class2,7.471,632,52635.582,Class2,7.462,669,119870.828,Class2,7.466,711,53030.613,Class3,7.467,582,27430.087,Class3,7.471,531,16584.042,Class3,7.471,590,24280.179,,0,0,,Class4,7.471,729,79478.187,Class4,7.466,677,107915.5
unknown,79,620.4,7.607,5,71,Class2,7.604,468,19773.433,Class2,7.6,705,43540.231,Class2,7.604,672,17715.542,,0,0,,,0,0,,,0,0,,,0,0,,Class4,7.613,641,30095.283,Class4,7.613,616,33211.654
"2-Butenal, 2-methyl-",80,793.75,7.677,8,84,Class2,7.675,739,217321.386,Class2,7.675,824,1640903.95,Class2,7.675,833,2163155.39,Class3,7.675,848,2487138.19,Class3,7.68,782,1889121.36,Class3,7.68,782,623169.464,Class4,7.68,725,353619.928,Class4,7.68,817,2381556.49,,0,0,
Undecane,81,754.0833,7.739,12,57,Class2,7.737,682,115077.407,Class2,7.737,755,135358.321,Class2,7.737,701,189166.631,Class3,7.738,758,244056.286,Class3,7.742,755,176224.585,Class3,7.742,701,173326.938,Class4,7.742,762,176813.649,Class4,7.742,775,330998.851,Class4,7.737,800,424190.692
"Tetrasiloxane, decamethyl-",82,904.1667,7.847,12,207,Class2,7.844,955,331706.252,Class2,7.84,856,308480.26,Class2,7.844,915,331663.989,Class3,7.844,879,364731.738,Class3,7.844,686,292659.141,Class3,7.849,956,321566.913,Class4,7.849,948,335262.73,Class4,7.844,928,379918.639,Class4,7.844,876,344445.349
Analyte 86,83,610.25,7.962,6,20,,0,0,,Class2,7.924,459,262882.257,,0,0,,Class3,8.022,0,501427.061,Class3,8.022,800,398630.801,,0,0,,Class4,7.933,579,307590.593,Class4,7.96,603,351589.387,,0,0,
Analyte 87,84,557.6667,7.989,8,28,Class2,8.017,686,185771.732,Class2,7.937,480,70343.994,,0,0,,Class3,8.031,0,67742.511,Class3,8.035,508,85679.624,,0,0,,Class4,7.946,569,65193.359,Class4,7.969,0,118868.186,Class4,8.048,627,109510.08
"N(1)-[4-[4-Methoxyphenyl]-6-[trichloromethyl]-2-pyrimidinyl]-N(2),N(2)-",85,639,8.078,6,72,,0,0,,Class2,8.08,0,17613.257,,0,0,,,0,0,,Class3,8.071,0,32090.639,,0,0,,,0,0,,Class4,8.084,686,61950.658,,0,0,
"2,2-Dimethyl-propyl 2,2-dimethyl-propanesulfinyl sulfone",86,535.8182,8.162,11,33,Class2,8.168,547,58386.751,Class2,8.151,549,107462.822,Class2,8.186,547,141064.54,Class3,8.164,557,164536.072,Class3,8.177,505,146634.794,Class3,8.191,557,42700.867,Class4,8.155,528,98024.572,Class4,8.16,529,131784.813,Class4,8.168,555,202967.813
Ethylbenzene,87,886.4167,8.479,12,91,Class2,8.479,781,249018.075,Class2,8.488,909,227548.994,Class2,8.461,944,219502.821,Class3,8.475,900,215174.091,Class3,8.479,951,648674.46,Class3,8.462,875,231862.251,Class4,8.497,916,285687.794,Class4,8.493,913,222573.895,Class4,8.47,891,267284.493
"1-Butanol, 2-methyl-, acetate",88,701.0833,8.538,12,70,Class2,8.537,695,14600093,Class2,8.546,702,14387671.1,Class2,8.524,703,11163407.3,Class3,8.533,703,6921381.79,Class3,8.541,704,18940117.2,Class3,8.524,706,9012325.45,Class4,8.55,690,17692041.6,Class4,8.546,703,15714838.1,Class4,8.533,699,19656918.6
3-Methylpentyl acetate,89,483.25,8.572,12,87,Class2,8.572,494,375355.005,Class2,8.581,478,580652.817,Class2,8.559,491,338461.425,Class3,8.568,499,286436.242,Class3,8.572,453,561896.741,Class3,8.559,467,278184.754,Class4,8.573,508,826711.015,Class4,8.582,505,399667.732,Class4,8.568,477,606021.48
unknown,90,754.5,8.7,10,106,Class2,8.701,799,48960.717,Class2,8.719,598,52422.391,Class2,8.683,869,39711.019,Class3,8.697,860,42227.833,Class3,8.706,799,114065.551,Class3,8.684,853,46122.432,Class4,8.728,648,82054.675,,0,0,,Class4,8.697,851,59534.722
"Cyclobutanecarboxylic acid, 4-methylpentyl ester",91,704.5,8.749,12,84,Class2,8.75,653,504236.463,Class2,8.741,721,457797.194,Class2,8.741,642,579396.635,Class3,8.741,745,502151.966,Class3,8.741,669,523981.928,Class3,8.759,685,549161.101,Class4,8.759,734,379406.159,Class4,8.755,754,726236.089,Class4,8.746,544,115043.182
2-Phenylpropyl butyrate,92,515.0909,8.809,11,118,Class2,8.799,381,24209.92,Class2,8.808,524,71839.322,Class2,8.817,479,1621.932,Class3,8.813,555,22623.182,,0,0,,Class3,8.821,462,3793.281,Class4,8.813,510,24828.301,Class4,8.808,488,43372.352,Class4,8.795,582,76632.349
"Benzene, 1,3-dimethyl-",93,895,8.901,12,91,Class2,8.901,918,275510.464,Class2,8.915,906,293616.093,Class2,8.879,934,244639.934,Class3,8.897,907,251588.106,Class3,8.901,944,574155.573,Class3,8.879,919,285649.852,Class4,8.915,921,312217.739,Class4,8.915,908,299992.356,Class4,8.892,918,281343.618
"2-Propanol, 1,1-dimethoxy-",94,611.4,9.085,12,47,Class2,9.074,645,31636.855,Class2,9.088,687,2779.048,Class2,9.114,510,24701.139,Class3,9.079,656,108755.079,Class3,9.092,673,18235.263,Class3,9.128,390,43411.415,Class4,9.057,0,191078.276,Class4,9.066,595,340267.864,Class4,9.083,0,254000.016
"2-Azido-2,4,4,6,6-pentamethylheptane",95,591.75,9.141,4,75,Class2,9.132,638,31904.793,Class2,9.154,592,18970.642,,0,0,,,0,0,,,0,0,,,0,0,,Class4,9.155,592,27771.291,,0,0,,Class4,9.123,545,78040.5
"1,3-Cyclopentanedione, 4-(3-methylbutyl)-",96,648.875,9.213,8,70,,0,0,,,0,0,,,0,0,,Class3,9.199,647,32484.79,,0,0,,Class3,9.163,611,24772.098,Class4,9.248,632,23310.209,Class4,9.235,657,47674.028,Class4,9.199,655,52256.252
"2-Pentenal, 2-methyl-",97,729.2,9.309,5,98,,0,0,,Class2,9.31,750,167684.466,Class2,9.305,764,399798.747,Class3,9.306,779,628737.969,Class3,9.314,770,974567.001,,0,0,,,0,0,,Class4,9.31,583,32519.908,,0,0,
"Silanol, ethyldimethyl-",98,707,9.556,7,75,Class2,9.554,671,58228.328,,0,0,,Class2,9.599,816,65427.859,,0,0,,,0,0,,Class3,9.608,759,30620.352,Class4,9.537,547,45812.986,Class4,9.541,680,49786.189,Class4,9.568,605,54515.601
4-Methyl-5-nonanone,99,620,9.452,8,85,Class2,9.474,556,28965.321,Class2,9.483,646,34824.447,Class2,9.412,636,41391.822,Class3,9.461,594,36501.558,,0,0,,,0,0,,Class4,9.492,638,23378.366,,0,0,,Class4,9.452,616,88621.925
"Cyclobutane, 1,2,3,4-tetramethyl-",100,724.5,9.604,12,56,Class2,9.599,764,901910.408,Class2,9.581,760,1440367.3,Class2,9.63,752,2789444.28,Class3,9.603,685,6473396.51,Class3,9.607,748,3173406.91,Class3,9.639,742,849756.418,Class4,9.585,762,1255256.97,Class4,9.59,689,2512213.04,Class4,9.608,722,1832391.39
"Undecane, 3-methyl-",101,636.25,9.755,12,85,Class2,9.758,560,24099.39,Class2,9.79,589,33861.64,Class2,9.71,669,43444.106,Class3,9.754,578,53621.704,Class3,9.754,698,35502.822,Class3,9.692,597,29300.472,Class4,9.794,646,32484.918,Class4,9.79,711,40736.925,Class4,9.741,705,60999.291
4-Methyl-2-pentyl methylphosphonofluoridate,102,482.5,9.809,4,69,Class2,9.803,463,6358.281,Class2,9.812,550,38054.174,,0,0,,,0,0,,Class3,9.812,450,31507.08,,0,0,,Class4,9.808,467,11494.692,,0,0,,,0,0,
"Benzene, 1,2,3-trimethyl-",103,566,9.933,3,105,,0,0,,,0,0,,,0,0,,Class3,9.941,440,4335.633,Class3,9.941,763,49713.017,,0,0,,,0,0,,,0,0,,Class4,9.918,495,14352.467
"Cyclohexane, pentyl-",104,645.6,10.038,5,82,Class2,10.069,563,15222.509,,0,0,,Class2,10.025,671,24437.203,Class3,10.065,636,19017.579,,0,0,,,0,0,,,0,0,,,0,0,,Class4,10.061,696,45647.371
"Hexane, 3,4-bis(1,1-dimethylethyl)-2,2,5,5-tetramethyl-",105,817.0833,9.998,12,57,Class2,9.994,738,641306.825,Class2,9.981,845,437739.578,Class2,10.016,763,515742.903,Class3,9.999,829,432044.665,Class3,9.998,790,453715.54,Class3,10.021,809,637594.28,Class4,9.985,840,535863.926,Class4,9.99,859,1193598.69,Class4,10.003,869,705205.636
unknown,106,486.3333,10.101,3,163,Class2,10.092,571,8034.866,,0,0,,Class2,10.083,437,10544.253,,0,0,,,0,0,,,0,0,,Class4,10.127,451,6395.488,,0,0,,,0,0,
"Succinic acid, tridec-2-yn-1-yl 2,2,3,4,4,4-hexafluorobutyl ester",107,534,10.194,4,125,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,10.221,589,9115.856,Class4,10.212,553,11208.16,Class4,10.189,518,10009.919
"Acetic acid, pentyl ester",108,667.0909,10.144,12,70,Class2,10.145,725,580795.431,Class2,10.154,708,529359.387,Class2,10.132,709,268084.471,Class3,10.141,705,208934.063,Class3,10.145,723,617650.432,Class3,10.127,722,300920.518,Class4,10.158,0,465942.783,Class4,10.154,711,326198.67,Class4,10.141,724,412023.813
o-Xylene,109,875.9167,10.243,12,91,Class2,10.247,825,179466.266,Class2,10.261,875,193228.644,Class2,10.225,893,157014.103,Class3,10.238,858,140131.93,Class3,10.243,888,312508.224,Class3,10.216,870,179690.578,Class4,10.256,929,188082.464,Class4,10.256,824,181324.243,Class4,10.234,894,213286.81
"Propionic acid, 2-(3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazin-6-ylamino)-, hydrazide",110,408.6667,10.306,3,155,,0,0,,,0,0,,,0,0,,Class3,10.301,389,5069.285,Class3,10.327,474,3378.143,Class3,10.292,363,4648.75,,0,0,,,0,0,,,0,0,
"Cyclopentasiloxane, decamethyl-",111,966.3333,10.317,12,73,Class2,10.318,967,4966726.3,Class2,10.323,965,5222383.15,Class2,10.309,965,5502403,Class3,10.314,964,5199177.84,Class3,10.318,968,5266817.61,Class3,10.309,962,4817513.26,Class4,10.323,968,4801986.24,Class4,10.323,969,4212251.04,Class4,10.314,968,5145945.93
Heptanal,112,718,10.43,12,70,Class2,10.429,768,3934030.71,Class2,10.438,702,3372478.7,Class2,10.416,748,2375125.47,Class3,10.429,735,2418212.27,Class3,10.429,751,2286743.83,Class3,10.416,768,4277210.51,Class4,10.438,765,2478362.39,Class4,10.438,763,4400460.5,Class4,10.425,710,566914.041
"Cyclopentasiloxane, decamethyl-",113,907.2727,10.464,11,73,Class2,10.469,918,410010.78,Class2,10.478,908,291592.938,Class2,10.474,943,229895.724,Class3,10.465,941,427693.334,Class3,10.465,897,403975.868,Class3,10.478,888,112415.082,Class4,10.456,935,843935.324,Class4,10.46,936,781641.58,Class4,10.469,941,360016.263
unknown,114,707.5,10.474,6,79,,0,0,,Class2,10.465,746,244798.272,,0,0,,Class3,10.483,713,203368.85,Class3,10.478,771,156336.903,,0,0,,,0,0,,Class4,10.483,701,215279.916,,0,0,
Pyridine,115,849.6,10.527,6,52,Class2,10.527,799,130328.325,,0,0,,Class2,10.491,937,82368.337,,0,0,,,0,0,,,0,0,,Class4,10.5,0,58755.743,,0,0,,Class4,10.545,801,54410.52
"3,4-Di-O-methyl-L-arabinopyranose",116,518,10.667,10,87,Class2,10.665,490,38876.388,Class2,10.647,436,27851.074,Class2,10.678,555,41801.281,Class3,10.669,500,32934.89,Class3,10.665,506,29371.627,Class3,10.691,499,35007.5,,0,0,,Class4,10.656,528,42332.555,,0,0,
unknown,117,631.1,10.687,10,70,Class2,10.687,690,231107.933,Class2,10.669,719,275237.238,Class2,10.709,578,50253.467,Class3,10.687,695,117483.227,Class3,10.691,690,86328.916,Class3,10.714,481,49785.918,Class4,10.674,629,200494.169,Class4,10.678,665,307194.214,Class4,10.691,449,23586.831
4-Heptenal,118,648.3333,10.818,9,68,Class2,10.816,590,204892.662,Class2,10.825,702,290738.589,Class2,10.811,629,261612.08,,0,0,,,0,0,,Class3,10.807,638,184907.763,Class4,10.825,638,271081.411,Class4,10.825,693,265603.415,,0,0,
Dodecane,119,780.1818,10.824,12,57,Class2,10.829,766,473662.541,Class2,10.856,795,500658.078,Class2,10.785,0,809317.497,Class3,10.82,779,832388.603,Class3,10.816,694,441269.753,Class3,10.776,686,538997.849,Class4,10.856,820,526673.295,Class4,10.847,824,826802.104,Class4,10.816,757,899109.608
"Pyrrolidine, 2-butyl-1-methyl-",120,633.1667,10.85,7,84,Class2,10.847,618,234805.924,,0,0,,Class2,10.856,740,299700.413,Class3,10.843,0,342411.035,Class3,10.847,619,275823.728,Class3,10.856,695,245703.04,,0,0,,,0,0,,Class4,10.838,532,200056.791
Methanesulfonic anhydride,121,753.0909,10.989,12,79,Class2,10.984,0,339054.196,Class2,10.971,742,269927.427,Class2,11.011,798,258500.399,Class3,10.989,764,262567.975,Class3,10.993,771,222687.428,Class3,11.016,780,286182.412,Class4,10.976,622,261721.496,Class4,10.98,785,249673.038,Class4,10.993,753,307527.497
unknown,122,762.2727,11.071,11,73,Class2,11.073,755,32559.007,Class2,11.073,774,27631.511,Class2,11.064,617,23655.962,Class3,11.069,849,41384.963,Class3,11.069,747,29192.285,Class3,11.065,794,33144.952,Class4,11.073,839,46134.205,Class4,11.073,840,46780.548,Class4,11.065,641,42402.562
Eucalyptol,123,762.7,11.098,12,154,Class2,11.096,0,36456.737,Class2,11.109,728,34527.082,Class2,11.078,789,32799.463,Class3,11.096,786,29703.712,Class3,11.104,772,25934.154,Class3,11.078,720,24241.221,Class4,11.113,0,24433.801,Class4,11.105,733,21046.691,Class4,11.096,715,21881.419
unknown,124,670.2,11.21,11,57,Class2,11.215,0,61223.78,Class2,11.22,778,97470.342,Class2,11.229,692,33698.811,Class3,11.211,732,85432.024,Class3,11.211,629,31753.794,Class3,11.162,530,15674.778,Class4,11.216,648,78614.482,Class4,11.22,707,105238.646,Class4,11.22,714,81034.496
unknown,125,595.0833,11.333,12,85,Class2,11.335,622,221544.739,Class2,11.335,549,124886.756,Class2,11.318,622,26476.264,Class3,11.34,637,60540.872,Class3,11.34,606,496931.671,Class3,11.322,676,86307.014,Class4,11.34,513,154730.484,Class4,11.336,570,245107.158,Class4,11.318,540,252076.837
"1-Butanol, 2-methyl-",126,722.75,11.37,9,56,Class2,11.366,0,3630448.64,Class2,11.358,721,3109229.88,Class2,11.38,733,4293085.59,Class3,11.371,688,3637570.07,Class3,11.371,727,4505609.51,Class3,11.384,712,2887114.03,Class4,11.362,731,4757480.73,Class4,11.362,748,7104965.75,Class4,11.371,722,7576588.51
"Cyclobutane, 1,1,2,3,3-pentamethyl-",127,757.4167,11.406,12,55,Class2,11.402,663,7096130.75,Class2,11.393,773,6148868.43,Class2,11.42,744,7909915.33,Class3,11.407,698,10578623.9,Class3,11.406,736,7460146.2,Class3,11.42,796,6764473.3,Class4,11.398,785,11831082.6,Class4,11.402,761,12062308.7,Class4,11.411,753,19916716.8
"1,3-bis[(2Z)-Hex-2-en-1-yloxy]-1,1,3,3-tetramethyldisiloxane",128,687.1667,11.464,12,149,Class2,11.464,669,1529716.92,Class2,11.46,653,1348313.77,Class2,11.469,685,1375619.85,Class3,11.464,653,1306088.46,Class3,11.464,705,1163665.59,Class3,11.473,710,1352903.84,Class4,11.46,691,1215957.67,Class4,11.46,704,1390580.03,Class4,11.464,660,1290737.17
unknown,129,575.6667,11.483,7,155,Class2,11.486,589,11462.067,Class2,11.487,0,15439.332,,0,0,,Class3,11.491,598,12193.895,Class3,11.491,598,10582.638,,0,0,,Class4,11.482,663,13214.611,Class4,11.478,360,16804.603,,0,0,
"2-Hexenal, (E)-",130,647.5,11.542,6,98,Class2,11.557,675,108692.17,Class2,11.54,504,10123.924,,0,0,,,0,0,,,0,0,,,0,0,,Class4,11.549,704,99810.522,Class4,11.544,727,148520.386,,0,0,
"2-Buten-1-ol, (Z)-",131,616.8333,11.646,7,72,,0,0,,Class2,11.638,526,25822.611,Class2,11.66,686,378810.395,Class3,11.647,0,333728.958,Class3,11.646,732,246947.621,,0,0,,Class4,11.642,542,37280.442,Class4,11.642,683,84384.729,Class4,11.651,532,78680.474
"Benzoic acid, 4-methyl-2-trimethylsilyloxy-, trimethylsilyl ester",132,591.9091,11.661,11,281,Class2,11.66,580,22061.21,Class2,11.664,518,28579.799,,0,0,,Class3,11.664,594,21980.747,Class3,11.66,623,24599.712,Class3,11.655,566,20310.577,Class4,11.66,576,29470.111,Class4,11.664,547,19442.043,Class4,11.66,586,26815.164
unknown,133,508.1818,11.738,11,43,Class2,11.735,522,268062.621,Class2,11.735,604,117359.217,Class2,11.74,519,232785.463,Class3,11.74,524,627474.261,Class3,11.74,490,239262.944,Class3,11.744,533,522620.968,Class4,11.735,489,129516.753,Class4,11.74,530,135082.228,Class4,11.74,456,88468.005
"Morpholine, 4-[5-(2-furfurylthio)-2-nitrophenyl]-",134,576.75,11.797,4,45,,0,0,,Class2,11.815,656,50646.656,,0,0,,,0,0,,,0,0,,,0,0,,Class4,11.811,473,60421.198,Class4,11.82,542,97702.545,,0,0,
"Furan, 2-pentyl-",135,904.8,11.821,12,81,Class2,11.824,874,470513.143,Class2,11.837,0,348491.777,Class2,11.802,879,204677.675,Class3,11.82,863,272065.739,Class3,11.82,875,268033.991,Class3,11.798,0,698805.955,Class4,11.838,919,684473.535,Class4,11.833,878,764347.868,Class4,11.815,927,1007158.37
"Undecane, 2,9-dimethyl-",136,594,11.876,3,71,,0,0,,Class2,11.909,634,25615.537,Class2,11.846,585,16038.395,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,11.873,563,24910.634
"Hexanoic acid, ethyl ester",137,724.5,11.978,4,88,Class2,11.979,837,85226.045,,0,0,,,0,0,,,0,0,,Class3,11.979,697,42041.061,Class3,11.962,691,64495.964,Class4,11.993,673,21460.414,,0,0,,,0,0,
unknown,138,713.0909,12.049,11,81,Class2,12.051,638,73522.68,Class2,12.042,668,76866.806,,0,0,,Class3,12.055,493,39401.406,Class3,12.051,536,32492.258,Class3,12.064,657,37433.567,Class4,12.042,805,140523.2,Class4,12.042,818,139410.665,Class4,12.051,686,126105.432
"L-Alanyl-L-norleucine, N-dimethylaminomethylene-, methyl ester",139,673,12.104,3,99,,0,0,,,0,0,,Class2,12.099,599,38272.816,Class3,12.108,603,29122.934,Class3,12.104,817,28934.631,,0,0,,,0,0,,,0,0,,,0,0,
"2-Octene, 2,6-dimethyl-",140,724.8333,12.202,12,140,Class2,12.206,717,623944.879,Class2,12.215,727,621958.898,Class2,12.184,717,259143.381,Class3,12.202,723,164540.452,Class3,12.202,720,617741.217,Class3,12.18,734,859498.094,Class4,12.215,730,945983.738,Class4,12.215,717,1084703.85,Class4,12.197,744,823217.82
"Sulfurous acid, 2-ethylhexyl nonyl ester",141,622,12.287,4,85,Class2,12.299,615,37857.136,,0,0,,Class2,12.277,615,27043.83,,0,0,,,0,0,,Class3,12.277,577,26214.651,,0,0,,,0,0,,Class4,12.295,681,73036.472
unknown,142,742.5,12.311,12,73,Class2,12.313,813,49531.361,Class2,12.313,784,60995.016,Class2,12.308,572,47839.202,Class3,12.308,600,50042.518,Class3,12.313,627,47019.114,Class3,12.304,733,39169.46,Class4,12.317,877,56268.325,Class4,12.313,653,35500.07,Class4,12.308,781,57165.252
Cyclopentene,143,536.3333,12.367,10,86,Class2,12.37,567,168214.431,Class2,12.375,539,61884.573,Class2,12.366,541,22311.102,Class3,12.366,539,28404.528,Class3,12.366,513,34618.303,Class3,12.357,508,39723.345,Class4,12.375,478,75567.894,Class4,12.375,561,21733.244,Class4,12.366,581,100013.631
unknown,144,621.2,12.413,10,83,Class2,12.424,538,77545.802,Class2,12.397,663,55027.347,,0,0,,,0,0,,Class3,12.415,714,61818.1,Class3,12.437,501,43518.54,Class4,12.406,587,153009.054,Class4,12.411,702,154425.264,Class4,12.415,615,85631.036
unknown,145,436.5,12.419,12,65,Class2,12.419,462,47102.027,Class2,12.419,341,23968.658,Class2,12.419,601,72784.28,Class3,12.419,529,35874.23,Class3,12.419,361,28751.608,Class3,12.419,411,19961.137,Class4,12.419,411,33764.441,Class4,12.419,418,51251.281,Class4,12.419,369,94182.078
"Isoquinoline, 6,7-dimethoxy-1-methyl-4-(3,4-dimethylphenyl)-",146,577.2,12.456,5,154,,0,0,,Class2,12.455,690,4381.985,,0,0,,,0,0,,Class3,12.45,455,8750.278,,0,0,,Class4,12.455,579,9715.177,,0,0,,Class4,12.455,558,11734.484
Styrene,147,868.9,12.501,10,104,Class2,12.504,804,294370.837,,0,0,,Class2,12.495,890,85316.797,Class3,12.499,920,150293.118,Class3,12.504,958,1612221.35,Class3,12.495,898,226222.01,Class4,12.513,941,354400.705,Class4,12.513,862,337416.774,Class4,12.499,873,308864.6
Isobutyl 3-methylbut-3-enyl carbonate,148,511.75,12.535,9,56,Class2,12.53,509,68490.257,Class2,12.526,394,67116.696,,0,0,,Class3,12.535,563,98074.025,Class3,12.539,449,75811.146,Class3,12.548,647,69322.322,,0,0,,Class4,12.535,514,168901.946,,0,0,
"4-Methyl-3,5-decandione",149,624.1818,12.548,12,99,Class2,12.548,547,164321.133,Class2,12.553,594,206312.634,Class2,12.539,663,256916.282,Class3,12.548,648,497228.65,Class3,12.548,618,348347.08,Class3,12.539,611,170538.355,Class4,12.553,647,253883.18,Class4,12.553,648,353568.683,Class4,12.544,647,267533.147
"Propane, 1-(methylthio)-",150,552.5556,12.616,9,90,Class2,12.615,656,1110634.62,Class2,12.615,438,352302.029,,0,0,,Class3,12.615,569,167301.061,Class3,12.619,562,103904.09,Class3,12.615,626,1255265.21,Class4,12.615,526,270713.769,Class4,12.615,682,1010441.81,Class4,12.615,399,59221.564
"Cyclobutanone, 2,3,3,4-tetramethyl-",151,735.8333,12.642,12,42,Class2,12.641,735,2233017.03,Class2,12.633,683,1155213.91,Class2,12.65,731,1879600.47,Class3,12.642,741,2355049.89,Class3,12.641,732,1566437.43,Class3,12.65,735,1801368.78,Class4,12.637,746,2374332.62,Class4,12.637,742,3951389.83,Class4,12.641,751,3626047.75
"L-Proline, N-(octanoyl)-, heptyl ester",152,649.8,12.662,5,104,Class2,12.668,737,64856.899,Class2,12.646,668,51720.322,,0,0,,Class3,12.668,606,38211.99,Class3,12.664,805,338193.747,,0,0,,,0,0,,,0,0,,Class4,12.664,433,71679.498
3-Octanone,153,592.5,12.689,5,99,,0,0,,,0,0,,,0,0,,Class3,12.695,688,82204.059,Class3,12.699,554,57151.889,,0,0,,Class4,12.682,0,64122.321,,0,0,,Class4,12.695,521,43193.36
"Cycloheptanemethanol, dimethyl-",154,734.3333,12.748,4,59,,0,0,,,0,0,,Class2,12.757,762,213938.62,Class3,12.744,741,121692.471,Class3,12.744,0,138399.246,,0,0,,,0,0,,,0,0,,Class4,12.748,700,80208.076
"2-Allylpent-4-enoic acid, benzyl ester",155,719.5833,12.788,12,91,Class2,12.788,731,75839.794,Class2,12.784,732,125877.166,Class2,12.797,766,141683.183,Class3,12.788,717,113920.591,Class3,12.788,691,128276.795,Class3,12.801,841,83347.636,Class4,12.779,711,90371.522,Class4,12.784,806,119657.296,Class4,12.788,706,32197.165
"Dodecane, 4,6-dimethyl-",156,565,12.912,4,71,Class2,12.908,506,28567.467,Class2,12.926,591,24361.647,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,12.912,598,29596.36,Class4,12.904,0,34448.028
"2,4,4,6-Tetramethyl-6-phenylheptane",157,652.1429,12.896,7,119,Class2,12.895,608,39610.768,Class2,12.908,720,31387.839,Class2,12.877,538,30632.63,,0,0,,Class3,12.899,640,26706.597,,0,0,,,0,0,,,0,0,,,0,0,
"Pyrrolidin-2-one, 5-[2-butyrylethyl]-",158,629,12.983,12,84,Class2,12.983,609,155721.616,Class2,12.992,642,247297.222,Class2,12.97,634,122506.702,Class3,12.979,608,211860.969,Class3,12.983,693,99937.647,Class3,12.966,682,400356.299,Class4,12.992,628,294882.845,Class4,12.992,634,352440.271,Class4,12.983,664,248635.226
"Acetic acid, hexyl ester",159,755.1667,13.126,12,56,Class2,13.126,738,2156708.08,Class2,13.13,758,1349744.16,Class2,13.117,758,635467.5,Class3,13.126,752,565120.281,Class3,13.126,770,1773362.11,Class3,13.117,761,866608.561,Class4,13.135,763,961830.613,Class4,13.13,774,1104817.09,Class4,13.121,756,854179.027
unknown,160,460.6667,13.149,3,97,,0,0,,,0,0,,,0,0,,Class3,13.157,491,37475.751,,0,0,,,0,0,,,0,0,,Class4,13.148,409,60696.859,Class4,13.143,482,47844.959
unknown,161,701.9167,13.256,12,56,Class2,13.254,775,389396.453,Class2,13.25,758,313655.309,Class2,13.263,719,62889.698,Class3,13.255,636,83531.698,Class3,13.259,721,277887.964,Class3,13.272,683,62279.622,Class4,13.25,766,202027.734,Class4,13.255,728,216613.321,Class4,13.259,660,113625.078
"Cyclopentane, nonyl-",162,625.4,13.326,5,82,,0,0,,,0,0,,,0,0,,Class3,13.348,671,21582.381,Class3,13.339,646,14112.556,Class3,13.317,547,17993.67,,0,0,,,0,0,,Class4,13.334,640,18578.893
Tolycaine,163,794.5556,13.357,9,86,Class2,13.357,754,189493.111,Class2,13.352,787,326616.972,Class2,13.361,844,132463.702,Class3,13.357,794,259708.753,Class3,13.357,833,315077.657,Class3,13.361,841,349406.135,Class4,13.352,749,356270.469,Class4,13.357,790,629219.033,Class4,13.361,759,323531.7
unknown,164,743.3333,13.42,12,45,Class2,13.419,772,13499415.4,Class2,13.41,762,26224361.9,Class2,13.432,764,31430081.1,Class3,13.428,763,64902901.7,Class3,13.423,802,36045463.7,Class3,13.437,743,27803375.6,Class4,13.41,803,24165057.2,Class4,13.419,803,55881672.4,Class4,13.428,788,66884658.9
"Benzoic acid 3,5-dichloro-2,6-dimethyl-4-pyridyl ester",165,770.75,13.437,4,105,,0,0,,Class2,13.437,788,102267.476,,0,0,,,0,0,,Class3,13.441,780,169738.401,,0,0,,Class4,13.432,778,62141.249,Class4,13.437,737,114042.121,,0,0,
"Acetic acid, diphenyl-hydroxy-, 1-dimethylaminoisopropyl ester",166,605.875,13.45,8,58,Class2,13.45,584,202501.121,Class2,13.45,639,380485.589,Class2,13.445,607,825289.591,,0,0,,Class3,13.45,649,730883.043,Class3,13.454,532,258023.404,,0,0,,Class4,13.45,638,376812.623,Class4,13.445,605,442961.214
"1,4-Cyclohexanediol, trans-",167,603.375,13.469,8,98,Class2,13.468,573,93575.421,Class2,13.468,637,52313.459,Class2,13.472,560,76670.163,,0,0,,,0,0,,Class3,13.472,568,74845.381,Class4,13.472,574,55147.938,,0,0,,,0,0,
"Oxamide, N-(3-methoxypropyl)-N'-cycloheptylidenamino-",168,509.7778,13.489,9,153,,0,0,,Class2,13.485,504,26403.616,,0,0,,Class3,13.494,410,27748.195,Class3,13.49,608,26576.899,Class3,13.486,508,11523.052,Class4,13.486,523,26552.812,Class4,13.49,558,25422.217,Class4,13.485,512,30289.371
"3,4-Hexanediol, 2,5-dimethyl-",169,656.6667,13.542,3,73,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
Octanal,170,764.25,13.538,12,84,Class2,13.539,807,480153.378,Class2,13.543,797,361343.297,Class2,13.53,722,207834.847,Class3,13.539,768,257738.045,Class3,13.539,704,196239.126,Class3,13.53,796,567759.724,Class4,13.543,817,287164.632,Class4,13.543,798,439203.794,Class4,13.534,742,159407.056
"Erythro-2-methyl-3,4-dibromo-2-butanol",171,738.5,13.643,4,59,,0,0,,,0,0,,Class2,13.65,857,307732.909,Class3,13.641,607,194808.958,Class3,13.641,852,205484.279,,0,0,,,0,0,,,0,0,,Class4,13.641,638,135228.139
unknown,172,709.7273,13.655,11,84,Class2,13.659,776,112099.182,Class2,13.65,694,101555.12,Class2,13.663,681,25141.465,Class3,13.659,736,48382.517,Class3,13.654,669,37837.832,Class3,13.668,753,78194.253,Class4,13.659,609,77392.337,Class4,13.65,709,105932.524,Class4,13.659,671,30914.176
"Trisiloxane, 1,1,1,5,5,5-hexamethyl-3,3-bis[(trimethylsilyl)oxy]-",173,859.3333,13.739,12,281,Class2,13.739,874,69983,Class2,13.739,853,69546.082,Class2,13.739,891,63862.857,Class3,13.739,879,88695.13,Class3,13.739,827,64040.769,Class3,13.739,816,67242.318,Class4,13.739,900,79192.999,Class4,13.739,816,88601,Class4,13.739,803,79468.001
"2,6-Octadiene, 4,5-dimethyl-",174,637.2222,13.748,11,69,Class2,13.747,670,535366.455,Class2,13.752,693,371813.409,,0,0,,Class3,13.748,542,84489.072,Class3,13.747,632,335064.406,Class3,13.734,635,761437.103,Class4,13.756,0,591244.468,Class4,13.756,0,637073.061,Class4,13.748,698,514399.892
unknown,175,636.3,13.799,10,74,Class2,13.801,860,23782.15,Class2,13.792,516,35149.445,Class2,13.805,833,38772.007,Class3,13.796,525,51275.204,Class3,13.801,476,42291.912,Class3,13.819,741,18900.062,Class4,13.796,564,20709.605,Class4,13.796,999,42079.452,Class4,13.801,503,24252.92
"Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester",176,542,13.872,3,69,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,13.881,482,198057.471,,0,0,
Tridecane,177,720.4545,13.877,11,57,Class2,13.881,628,213265.539,Class2,13.894,737,191426.978,Class2,13.858,789,307185.945,Class3,13.876,773,313777.199,Class3,13.881,652,150625.325,Class3,13.859,748,226208.43,Class4,13.894,708,211356.831,Class4,13.894,732,360556.962,Class4,13.876,703,350447.167
"1-Cyclohexyl-2-buten-1-ol (c,t)",178,581.5,13.91,12,70,Class2,13.912,556,245515.838,Class2,13.912,538,164110.273,Class2,13.907,558,162676.604,Class3,13.908,617,256856.22,Class3,13.912,563,166002.724,Class3,13.908,580,254282.856,Class4,13.912,538,332731.884,Class4,13.912,560,360982.816,Class4,13.907,629,276745.405
3-Heptanol,179,580.25,13.941,4,59,,0,0,,,0,0,,Class2,13.943,385,20312.042,,0,0,,,0,0,,Class3,13.943,689,42458.614,Class4,13.939,586,58949.097,Class4,13.939,661,53064.452,,0,0,
1-Hepten-3-one,180,701.9,14.008,10,70,Class2,14.005,677,131480.408,,0,0,,Class2,14.018,774,25452.809,Class3,14.01,728,118275.638,Class3,14.005,688,76652.182,Class3,14.014,502,74547.299,Class4,14.001,781,193171.527,Class4,14.005,773,161192.303,Class4,14.005,744,98532.722
cis-2-(2-Pentenyl)furan,181,694.25,14.026,4,136,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,14.036,713,5641.702
unknown,182,657,14.06,10,57,Class2,14.058,674,100898.598,,0,0,,Class2,14.063,642,64096.056,Class3,14.059,692,81724.107,Class3,14.058,562,45671.031,,0,0,,Class4,14.063,705,75115.929,Class4,14.059,689,101966.368,Class4,14.054,766,90941.804
unknown,183,700.9,14.082,10,73,Class2,14.081,806,260381.19,Class2,14.085,622,52910.996,Class2,14.085,629,48514.453,Class3,14.085,591,50164.274,Class3,14.081,661,95280.933,Class3,14.085,766,344943.294,Class4,14.081,828,307159.278,Class4,14.081,630,54275.301,Class4,14.085,768,159359.678
"Cyclohexanone, 2,2,6-trimethyl-",184,783.5833,14.253,12,82,Class2,14.254,797,163529.479,Class2,14.258,774,167850.206,Class2,14.245,844,287364.482,Class3,14.25,820,250772.829,Class3,14.254,730,188803.432,Class3,14.245,765,156801.098,Class4,14.258,778,128622.677,Class4,14.258,857,296894.957,Class4,14.254,772,177492.225
"4-Methylheptane-3,5-dione",185,518.7143,14.368,8,57,Class2,14.374,452,16450.978,,0,0,,Class2,14.36,448,6066.356,,0,0,,Class3,14.369,408,18502.075,Class3,14.365,502,1160.543,Class4,14.369,0,61721.814,Class4,14.374,518,57797.915,Class4,14.369,672,364513.9
unknown,186,618.8,14.39,11,67,Class2,14.391,0,77180.198,Class2,14.387,655,51366.373,Class2,14.383,665,47172.347,Class3,14.387,619,40988.3,Class3,14.387,613,70623.197,Class3,14.387,675,26534.98,Class4,14.396,641,40285.656,Class4,14.392,427,27989.455,,0,0,
"2-Heptenal, (E)-",187,743.25,14.496,12,83,Class2,14.498,787,654800.708,Class2,14.498,747,198190.854,Class2,14.494,588,65170.74,Class3,14.498,704,58224.714,Class3,14.489,628,131075.414,Class3,14.494,798,593611.975,Class4,14.503,803,409590.986,Class4,14.494,799,1213804.25,Class4,14.498,737,128183.767
Ethyl 4-(ethyloxy)-2-oxobut-3-enoate,188,633.4545,14.594,12,71,Class2,14.591,541,359948.66,Class2,14.591,525,270415.34,Class2,14.587,611,185387.396,Class3,14.587,560,150575.376,Class3,14.587,572,211057.663,Class3,14.596,588,331541.599,Class4,14.596,572,425480.269,Class4,14.6,0,541894,Class4,14.614,607,656036.59
"Cyclobutanecarboxylic acid, cyclobutyl ester",189,513.75,14.636,4,45,,0,0,,,0,0,,,0,0,,Class3,14.636,498,48211.158,Class3,14.636,622,47937.717,,0,0,,Class4,14.636,415,67475.637,Class4,14.636,520,65344.254,,0,0,
Methylstyrene,190,542.75,14.687,4,117,,0,0,,,0,0,,,0,0,,,0,0,,Class3,14.698,608,11305.244,Class3,14.672,392,6360.605,Class4,14.707,533,3649.228,,0,0,,,0,0,
"2,2'-Trimethylenebis-1,3-dioxolane",191,719.9,14.679,12,73,Class2,14.676,675,62364.677,Class2,14.671,0,50859.865,Class2,14.689,702,118947.956,Class3,14.68,0,120852.39,Class3,14.68,590,44122.459,Class3,14.694,712,109643.113,Class4,14.672,726,215829.984,Class4,14.667,643,328670.892,Class4,14.68,758,263121.649
6-Octen-2-one,192,639,14.771,9,68,Class2,14.774,704,138015.608,Class2,14.769,553,128257.524,Class2,14.765,589,171132.44,Class3,14.769,693,214406.629,Class3,14.774,703,118192.441,Class3,14.769,705,129942.923,Class4,14.774,610,71024.591,Class4,14.774,571,297437.42,Class4,14.769,623,87967.972
"Disiloxane, 1,3-diethyl-1,1,3,3,-tetramethyl-",193,636.5,14.916,12,161,Class2,14.911,628,77834.854,Class2,14.916,653,67513.504,Class2,14.916,634,59507.165,Class3,14.916,659,56668.75,Class3,14.92,563,52471.223,Class3,14.916,593,58999.835,Class4,14.916,605,63225.78,Class4,14.916,573,58019.426,Class4,14.916,712,64426.658
"5-Hepten-2-one, 6-methyl-",194,788.3333,14.937,12,108,Class2,14.938,785,284428.452,Class2,14.938,778,276425.375,Class2,14.933,727,249339.376,Class3,14.934,791,307070.057,Class3,14.938,806,270510.603,Class3,14.934,799,310720.723,Class4,14.938,796,245560.925,Class4,14.938,776,330521.847,Class4,14.938,806,268710.63
"Cyclopentanone, 2-(1-methylpropyl)-",195,586.7778,14.953,9,84,Class2,14.956,633,109250.765,Class2,14.951,570,85521.122,Class2,14.942,539,28010.975,Class3,14.956,597,43242.395,Class3,14.956,610,83038.702,Class3,14.947,713,197944.661,Class4,14.96,543,42677.598,Class4,14.956,590,53984.092,,0,0,
"16-Methyl-heptadecane-1,2-diol, trimethylsilyl ether",196,645.1667,15.007,8,73,Class2,15.009,605,50858.801,,0,0,,Class2,15.004,0,57082.488,Class3,15.009,646,54006.689,Class3,15.004,0,56568.997,Class3,15.005,639,52235.597,,0,0,,,0,0,,Class4,15.009,623,45416.66
"Pyrimidine-2,4(1H,3H)-dione, 5-bromo-1-(1-methoxyethyl)-",197,677.25,15.028,4,59,Class2,15.027,572,96475.274,,0,0,,Class2,15.031,647,80743.985,Class3,15.027,720,79978.852,,0,0,,,0,0,,,0,0,,Class4,15.027,770,387613.095,,0,0,
"Butanoic acid, 4-hexenyl ester, (Z)-",198,665.6667,15.102,6,67,Class2,15.102,653,52177.024,Class2,15.102,705,49353.722,,0,0,,Class3,15.098,576,11678.133,Class3,15.107,710,26073.158,,0,0,,Class4,15.102,671,30371.741,,0,0,,Class4,15.098,679,33021.067
"(4-Methoxy-2,5-dimethyl-phenoxy)-trimethyl-silane",199,500.75,15.138,5,57,Class2,15.138,586,22179.632,Class2,15.142,473,27751.174,,0,0,,,0,0,,,0,0,,,0,0,,Class4,15.147,491,29727.539,Class4,15.134,0,30833.257,Class4,15.129,453,33311.437
unknown,200,792.0833,15.169,12,207,Class2,15.169,796,2240493.55,Class2,15.169,799,2439236.07,Class2,15.169,780,1744571.93,Class3,15.169,789,1821270.3,Class3,15.173,805,1742075.63,Class3,15.169,782,1535408.99,Class4,15.169,784,2115314.56,Class4,15.169,776,1610324.82,Class4,15.169,801,2069314.7
"Cyclohexasiloxane, dodecamethyl-",201,785.25,15.289,12,73,Class2,15.289,778,1999048.23,Class2,15.289,790,2225595.6,Class2,15.289,774,2064688.89,Class3,15.289,784,2088918.3,Class3,15.289,785,2229715.45,Class3,15.289,786,1869393.67,Class4,15.289,783,2208286.68,Class4,15.289,800,1876921.28,Class4,15.284,791,2293040.66
1-Triethylsilyloxyheptadecane,202,701.7778,15.3,9,127,Class2,15.298,634,59199.871,Class2,15.302,748,227918.884,Class2,15.298,682,148929.633,Class3,15.298,707,224514.269,Class3,15.302,702,582468.477,Class3,15.298,684,61756.804,Class4,15.302,713,101680.133,Class4,15.298,735,130128.064,Class4,15.302,711,203926.991
unknown,203,568.1667,15.387,6,103,Class2,15.391,707,67350.601,Class2,15.387,511,30493.438,,0,0,,,0,0,,,0,0,,Class3,15.387,557,29192.924,,0,0,,Class4,15.391,569,22740.029,Class4,15.382,475,16818.51
"Silane, cyclohexyldimethoxymethyl-",204,601.875,15.407,10,105,Class2,15.409,637,129370.661,Class2,15.409,896,932134.808,Class2,15.4,743,428738.704,Class3,15.404,0,90134.093,Class3,15.404,567,84567.341,Class3,15.404,0,10491.123,Class4,15.413,477,4393.688,Class4,15.409,485,40321.353,,0,0,
"1,6-Dioxaspiro[4.4]nonane, 2-ethyl-",205,756.2222,15.448,9,127,Class2,15.444,696,81176.042,Class2,15.453,744,263271.187,Class2,15.444,746,170778.237,Class3,15.449,808,263581.367,Class3,15.449,859,753713.52,Class3,15.444,686,65010.678,Class4,15.449,750,123940.908,Class4,15.453,680,155647.833,Class4,15.444,837,209349.883
"2,2-Dimethyloctadecane",206,517,15.51,5,99,,0,0,,Class2,15.52,492,13992.762,Class2,15.502,543,23381.191,Class3,15.511,452,31689.921,Class3,15.511,510,30685.128,,0,0,,,0,0,,,0,0,,Class4,15.507,588,15469.877
1-Hexanol,207,738.8182,15.536,12,56,Class2,15.533,759,8666129.27,Class2,15.533,760,10222336.9,Class2,15.538,0,15068509.7,Class3,15.538,755,13252617.4,Class3,15.542,756,23512070.5,Class3,15.538,722,5346029.81,Class4,15.538,648,14152961.5,Class4,15.538,756,24173634.5,Class4,15.533,762,15154482
"Pentane, 1,1,2,2,3,3,4,4-octafluoro-",208,517.6667,15.542,3,65,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,15.542,509,136171.189
unknown,209,695.6667,15.686,10,207,Class2,15.684,709,26948.07,Class2,15.684,777,29684.102,Class2,15.689,0,22053.044,,0,0,,,0,0,,Class3,15.684,637,20077.958,Class4,15.689,697,25723.746,Class4,15.684,632,21772.117,Class4,15.689,644,25881.453
"2-Octanol, acetate",210,661.4444,15.698,9,87,Class2,15.697,606,62007.932,Class2,15.702,751,124917.485,Class2,15.693,636,105530.642,Class3,15.702,572,99895.725,Class3,15.697,694,150235.844,Class3,15.693,680,92101.163,Class4,15.702,743,106193.036,Class4,15.698,602,78452.543,Class4,15.698,669,69230.082
"Nonadecane, 9-methyl-",211,599.75,15.771,4,57,,0,0,,,0,0,,,0,0,,Class3,15.778,602,54030.668,,0,0,,Class3,15.769,559,28047.911,,0,0,,,0,0,,Class4,15.782,523,50199.784
"Bicyclo[2.2.1]heptane, 2,2,3-trimethyl-",212,656,15.797,9,67,Class2,15.795,658,62908.19,Class2,15.809,650,93453.17,Class2,15.795,656,163594.648,Class3,15.795,730,93056.842,Class3,15.8,754,208747.51,Class3,15.795,511,32690.924,Class4,15.795,698,91169.639,Class4,15.795,623,96720.265,Class4,15.791,624,79803.854
"Acetic acid, heptyl ester",214,642.4,15.994,10,70,Class2,15.995,625,58347.976,Class2,16,550,71696.708,Class2,15.991,522,42769.185,Class3,15.995,713,51991.053,Class3,15.995,767,99412.377,Class3,15.986,461,26247.076,Class4,15.995,707,83594.743,Class4,15.995,665,74266.664,Class4,15.986,696,53804.019
Semustine,215,671.6,16.057,11,97,Class2,16.057,688,118636.932,Class2,16.062,585,196092.721,,0,0,,Class3,16.057,0,167391.928,Class3,16.053,568,90825.406,Class3,16.049,714,296158.826,Class4,16.062,670,236724.561,Class4,16.062,694,273444.716,Class4,16.053,813,186273.557
1-Octen-3-yl-acetate,216,817.0833,16.138,12,99,Class2,16.137,829,1092175.28,Class2,16.142,836,1368263.13,Class2,16.133,803,504750.395,Class3,16.137,762,285048.379,Class3,16.137,788,352786.522,Class3,16.133,821,462672.995,Class4,16.142,811,1566351.66,Class4,16.142,839,1314506.75,Class4,16.137,803,1105512.99
"1,3-Dioxolane, 2-methyl-2-(5-phenyl-3-pentenyl)-",217,631.8,16.174,10,87,Class2,16.173,671,1691824.96,Class2,16.173,672,724580.367,,0,0,,Class3,16.173,658,353234.708,Class3,16.173,636,394706.406,Class3,16.177,670,1535497.93,Class4,16.173,603,1154791.83,Class4,16.173,493,89587.495,Class4,16.173,586,226115.082
unknown,218,680.7143,16.203,8,99,Class2,16.199,768,348214.657,,0,0,,Class2,16.204,730,93748.495,,0,0,,Class3,16.199,706,55238.019,Class3,16.208,0,76952.381,,0,0,,Class4,16.2,693,364745.78,Class4,16.204,727,278942.52
unknown,219,596.8182,16.255,11,135,Class2,16.253,595,33160.105,Class2,16.253,740,35937.422,Class2,16.257,600,44151.799,Class3,16.257,556,37528.661,Class3,16.253,589,42377.429,Class3,16.257,436,24209.203,Class4,16.253,570,29065.989,Class4,16.253,636,38704.382,Class4,16.253,580,19094.45
"Acetic acid, 2-ethylhexyl ester",220,638.8333,16.273,12,109,Class2,16.27,712,22611.611,Class2,16.275,513,85828.284,Class2,16.27,689,46381.137,Class3,16.275,572,51415.332,Class3,16.275,591,147314.813,Class3,16.266,553,51132.672,Class4,16.275,655,24089.852,Class4,16.275,639,41279.692,Class4,16.271,690,26790.478
"3-Hexen-1-ol, (E)-",221,796.9091,16.341,12,67,Class2,16.342,822,622020.578,Class2,16.342,793,850664.911,Class2,16.342,0,1427659.77,Class3,16.342,832,1223220.76,Class3,16.342,836,1528882.63,Class3,16.342,846,756645.972,Class4,16.342,834,516169.05,Class4,16.342,824,994888.861,Class4,16.342,803,491544.2
"L-Aspartic acid, dimethyl ester",222,592.6667,16.356,3,102,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
Phenyltrimethylammonium chloride,223,560.4,16.358,5,120,,0,0,,Class2,16.359,552,49863.474,Class2,16.359,554,58591.981,Class3,16.355,586,64094.686,Class3,16.355,603,57127.205,,0,0,,Class4,16.36,507,23332.494,,0,0,,,0,0,
"Octanoic acid, methyl ester",224,594.1667,16.417,6,74,Class2,16.417,676,26712.738,,0,0,,,0,0,,Class3,16.417,432,15135.351,,0,0,,Class3,16.408,735,61900.654,Class4,16.422,471,12084.802,Class4,16.426,623,25822.253,Class4,16.413,628,22461.367
Nonanal,225,851.9,16.479,12,98,Class2,16.479,845,1177556.84,Class2,16.484,849,881690.854,Class2,16.47,850,389508.946,Class3,16.479,0,444651.321,Class3,16.479,861,522999.375,Class3,16.471,848,1529165.51,Class4,16.484,859,923669.708,Class4,16.479,0,1349119.45,Class4,16.475,852,766697.596
Nonanal,226,831.1111,16.545,11,68,Class2,16.546,857,319072.506,Class2,16.542,824,288914.138,Class2,16.546,821,75198.756,Class3,16.546,767,121129.443,Class3,16.546,826,113164.566,Class3,16.551,0,360382.308,,0,0,,Class4,16.542,864,363349.383,Class4,16.542,0,201197.024
unknown,227,484.125,16.605,8,179,Class2,16.608,445,5727.379,Class2,16.608,524,18246.805,Class2,16.604,542,33095.587,Class3,16.604,523,29701.915,Class3,16.604,490,30790.021,Class3,16.599,495,9479.21,Class4,16.608,448,10312.086,Class4,16.608,406,17105.926,,0,0,
"3-Hexyne, 2-methyl-",228,548.6667,16.642,3,80,,0,0,,,0,0,,,0,0,,Class3,16.644,489,33046.281,Class3,16.639,614,59465.23,Class3,16.644,543,108847.854,,0,0,,,0,0,,,0,0,
3-Octanol,229,674.75,16.651,12,83,Class2,16.648,695,355687.068,Class2,16.653,623,261394.98,Class2,16.648,642,152215.533,Class3,16.653,645,207869.783,Class3,16.652,656,200405.51,Class3,16.648,698,412082.835,Class4,16.653,786,836715.598,Class4,16.653,744,537140.478,Class4,16.648,802,370427.98
Isophorone,230,604.6,16.682,10,82,Class2,16.679,597,160315.348,Class2,16.679,556,162327.759,Class2,16.679,538,150825.609,Class3,16.684,604,156319.942,Class3,16.684,478,110421.765,,0,0,,Class4,16.684,623,161918.549,Class4,16.684,671,258942.009,Class4,16.679,671,209521.147
Tetradecane,231,792.3636,16.696,12,71,Class2,16.706,730,205230.58,Class2,16.706,802,167683.019,Class2,16.684,0,247969.85,Class3,16.693,813,270846.579,Class3,16.692,786,139488.891,Class3,16.684,787,233709.554,Class4,16.702,783,169756.56,Class4,16.702,816,232723.923,Class4,16.697,831,259832.796
Hexadecane,232,709.0909,16.785,11,85,Class2,16.777,778,51450.934,Class2,16.781,719,48212.12,Class2,16.786,761,48120.026,Class3,16.79,770,65873.05,Class3,16.79,677,39431.647,,0,0,,Class4,16.786,748,46321.739,Class4,16.786,723,70121.054,Class4,16.781,696,61163.68
Methyl 2-(methylthio)acetate,233,594.6667,16.814,11,61,Class2,16.812,616,157143.376,Class2,16.813,0,764170.187,Class2,16.821,433,20831.636,Class3,16.813,731,353391.384,Class3,16.812,676,214671.993,Class3,16.813,624,133536.807,Class4,16.813,685,318718.369,Class4,16.813,443,30155.753,Class4,16.813,0,55441.239
"Furan, 2-ethyl-5-methyl-",234,578,16.83,3,95,,0,0,,,0,0,,Class2,16.83,532,32607.622,Class3,16.83,584,27224.6,,0,0,,Class3,16.83,618,27384.285,,0,0,,,0,0,,,0,0,
Cyclohexylmethylsilane,235,818.3333,16.848,12,82,Class2,16.848,780,128344.934,Class2,16.848,754,155470.243,Class2,16.852,867,188426.13,Class3,16.848,880,188643.76,Class3,16.843,812,144112.339,Class3,16.853,831,229934.511,Class4,16.844,809,188144.169,Class4,16.844,823,308193.421,Class4,16.844,780,186157.537
unknown,236,718.7143,16.94,8,57,Class2,16.941,742,170788.609,,0,0,,Class2,16.937,748,119608.295,Class3,16.946,559,46108.172,Class3,16.937,744,102625.867,,0,0,,Class4,16.941,0,747123.452,Class4,16.941,775,546952.016,Class4,16.937,805,3525807.94
"trans-2,7-Dimethyl-4,6-octadien-2-ol",237,436,16.996,7,131,Class2,16.999,410,19098.245,Class2,16.999,513,15650.991,Class2,16.981,411,1547.8,Class3,16.99,448,10461.688,,0,0,,Class3,17.004,454,26346.06,Class4,16.999,470,44342.239,,0,0,,Class4,16.999,346,14936.877
2-Methyladamantane,238,628.8571,17.011,7,107,Class2,17.008,545,33639.865,Class2,17.012,669,38098.908,Class2,17.003,589,37900.591,Class3,17.012,589,37804.933,,0,0,,,0,0,,Class4,17.017,597,32523.066,Class4,17.017,689,38646.634,Class4,17.008,724,5384.16
5-Ethylcyclopent-1-enecarboxaldehyde,239,665.6667,17.027,9,95,Class2,17.035,605,54186.121,Class2,17.03,488,36537.629,,0,0,,,0,0,,,0,0,,Class3,17.021,695,58976.431,Class4,17.026,608,54422.318,Class4,17.026,558,72693.689,Class4,17.026,514,32387.75
"3-Hexen-1-ol, formate, (Z)-",240,534.75,17.095,8,67,Class2,17.088,556,80082.983,Class2,17.097,686,201603.937,Class2,17.097,500,86748.629,Class3,17.097,467,104481.38,Class3,17.097,623,247279.986,Class3,17.092,458,78455.61,Class4,17.097,498,112151.434,,0,0,,Class4,17.092,490,105008.934
"Furan, 3-(4-methyl-3-pentenyl)-",241,771.8571,17.158,9,69,Class2,17.159,769,114680.557,Class2,17.163,777,112758.917,Class2,17.154,762,83101.602,Class3,17.159,768,98941.924,Class3,17.159,797,116049.453,Class3,17.15,798,129646.316,Class4,17.164,732,66576.729,Class4,17.164,0,54528.663,Class4,17.155,0,41087.595
"2-Acetyl-2,3,5,6-tetrahydro-1,4-thiazine",242,622.1667,17.27,6,102,,0,0,,Class2,17.274,648,109072.854,Class2,17.265,675,77260.69,Class3,17.27,766,97026.326,Class3,17.27,692,63039.709,,0,0,,Class4,17.27,458,15130.383,Class4,17.27,494,22295.697,,0,0,
4-Fluoroimidazole-5-methanol,243,489.5,17.331,6,99,Class2,17.323,485,87936.354,Class2,17.337,406,90859.037,,0,0,,,0,0,,,0,0,,,0,0,,Class4,17.328,530,103032.891,Class4,17.328,528,40767.672,,0,0,
2-Octanol,244,699.8182,17.354,12,45,Class2,17.354,710,59178271.8,Class2,17.354,0,59296287.6,Class2,17.354,716,59146302.3,Class3,17.355,691,61838132.6,Class3,17.354,686,60837562.5,Class3,17.355,717,56754127.7,Class4,17.355,689,58282779,Class4,17.355,713,58728719.2,Class4,17.359,689,60105044.9
"2-Octenal, (E)-",245,621,17.4,4,93,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,17.395,481,9178.72,,0,0,
"Cyclopentene, 3-ethyl-",246,597.5556,17.49,9,67,Class2,17.483,533,128113.049,Class2,17.488,679,238792.572,Class2,17.492,545,74717.851,Class3,17.492,615,119462.279,Class3,17.488,709,265870.147,Class3,17.492,557,89401.205,Class4,17.488,600,179045.414,Class4,17.488,461,82987.656,Class4,17.497,679,140459.541
unknown,247,526.7143,17.601,7,70,Class2,17.603,504,29826.932,Class2,17.599,472,89210.888,,0,0,,Class3,17.599,512,41512.26,Class3,17.603,479,91787.248,Class3,17.59,532,31837.993,Class4,17.603,551,60310.156,,0,0,,Class4,17.612,637,48593.25
"5-Nonenal, (E)-",248,635.6667,17.732,3,81,,0,0,,,0,0,,,0,0,,,0,0,,Class3,17.736,612,32804.879,Class3,17.728,650,35704.435,,0,0,,Class4,17.732,645,36576.854,,0,0,
"Sulfurous acid, cyclohexylmethyl heptadecyl ester",249,569.3333,17.765,10,97,Class2,17.772,477,69199.486,Class2,17.768,533,114183.267,Class2,17.754,526,36426.684,Class3,17.772,540,65235.177,Class3,17.767,527,46593.819,Class3,17.759,621,126440.355,Class4,17.768,579,117942.225,Class4,17.772,642,111773.741,Class4,17.768,0,78944.754
"Cyclohexanol, 2-methyl-, trans-",250,517.375,17.716,8,146,Class2,17.714,448,14614.202,Class2,17.719,550,9723.36,Class2,17.705,588,16943.744,Class3,17.714,525,13714.225,Class3,17.705,573,18900.926,Class3,17.701,582,14239.904,Class4,17.714,451,13229.568,,0,0,,,0,0,
"Cyclotrisiloxane, hexamethyl-",251,822.4167,17.8,12,207,Class2,17.799,853,59950.335,Class2,17.803,874,77603.871,Class2,17.799,786,52162.184,Class3,17.799,806,52174.595,Class3,17.799,792,55384.94,Class3,17.799,735,43734.556,Class4,17.803,847,68182.468,Class4,17.799,868,46925.499,Class4,17.803,806,56501.354
Ethyl (methylthio)acetate,252,709.4545,17.874,12,61,Class2,17.874,878,4989437.7,Class2,17.879,886,3911257.33,Class2,17.87,502,172759.879,Class3,17.874,856,4100688.47,Class3,17.874,856,5930193.53,Class3,17.87,882,5761505.66,Class4,17.874,839,2280642.41,Class4,17.874,588,80326.172,Class4,17.87,600,529217.73
unknown,253,583.3,17.899,10,73,Class2,17.896,555,66077.747,Class2,17.896,558,63790.726,Class2,17.901,591,52637.051,Class3,17.896,590,70744.833,Class3,17.896,512,80882.547,,0,0,,Class4,17.896,583,56071.699,,0,0,,Class4,17.901,679,49424.436
"Megastigma-7(E),9,13-triene",254,619.875,17.955,9,161,Class2,17.954,638,47441.281,Class2,17.963,587,26305.38,Class2,17.945,603,27672.211,Class3,17.954,522,27151.649,Class3,17.958,0,25268.695,Class3,17.945,623,50112.253,Class4,17.963,630,24877.512,Class4,17.959,626,32000.898,Class4,17.95,730,50185.641
"6-Nonenal, (Z)-",255,851.0833,17.975,12,93,Class2,17.976,882,2844253.63,Class2,17.976,877,3024902.23,Class2,17.967,883,549865.488,Class3,17.972,872,783595.825,Class3,17.972,878,2596593.91,Class3,17.968,883,2639399.72,Class4,17.976,880,2013962.63,Class4,17.976,880,3215134.73,Class4,17.985,636,84334.354
"5-Hexadecenoic acid, 2-methoxy-, methyl ester",256,570.3636,18.014,11,104,Class2,18.012,586,346890.873,Class2,18.016,589,321888.717,Class2,18.012,560,400314.574,Class3,18.016,580,691396.501,Class3,18.016,561,469597.054,Class3,18.012,547,317524.573,Class4,18.012,495,102790.696,Class4,18.012,588,246496.123,,0,0,
1-Octen-3-ol,257,907.25,18.113,12,57,Class2,18.114,906,54426926.6,Class2,18.114,907,43022787.4,Class2,18.109,909,27378730.6,Class3,18.114,909,58025778.1,Class3,18.114,908,41984268.5,Class3,18.11,905,49370936.2,Class4,18.119,905,67379747.7,Class4,18.114,906,56872520.1,Class4,18.114,907,36044045.8
"Cyclopentane, 1-methyl-2-methylene-",258,628.6,18.244,5,96,Class2,18.247,626,50669.06,Class2,18.243,556,65821.034,Class2,18.243,666,92220.204,Class3,18.243,623,65300.235,Class3,18.243,672,79556.053,,0,0,,,0,0,,,0,0,,,0,0,
1-Heptanol,259,749.8333,18.264,12,70,Class2,18.265,766,1104739.29,Class2,18.265,791,2296553.05,Class2,18.261,802,3358280.75,Class3,18.265,792,3284344.42,Class3,18.265,800,5105191.94,Class3,18.261,675,336288.391,Class4,18.265,760,3546298.44,Class4,18.265,793,5068312.57,Class4,18.265,803,5569939.2
"2H-1,2-Oxazine, 6-(4-chlorophenyl)tetrahydro-2-methyl-",260,807.1667,18.296,7,45,Class2,18.225,857,8940575.61,Class2,18.305,800,2880479.04,,0,0,,Class3,18.332,794,1664307.24,,0,0,,Class3,18.314,843,1993254.49,Class4,18.278,0,5250935.86,Class4,18.314,733,3015702.38,,0,0,
unknown,261,670.3,18.317,11,110,Class2,18.314,772,61601.307,Class2,18.323,506,19631.238,Class2,18.314,529,26676.079,,0,0,,Class3,18.314,619,26385.248,Class3,18.31,0,37979.486,Class4,18.323,638,25071.622,Class4,18.323,430,52190.765,Class4,18.314,576,18651.317
"Heptane, 1,1'-oxybis-",262,500.2857,18.348,7,111,Class2,18.354,464,13216.784,Class2,18.349,419,16126.471,,0,0,,Class3,18.35,491,13050.848,,0,0,,Class3,18.345,610,14552.094,,0,0,,Class4,18.35,388,23902.839,,0,0,
"Cyclotetrasiloxane, octamethyl-",263,906.5,18.417,12,281,Class2,18.416,926,926495.679,Class2,18.416,912,1100977.82,Class2,18.416,908,576350.587,Class3,18.416,920,873201.229,Class3,18.416,883,710206.289,Class3,18.416,916,687301.277,Class4,18.416,912,1113601.85,Class4,18.416,913,794210.933,Class4,18.421,900,1064305.59
"6-Hepten-1-ol, 2-methyl-",264,619.4,18.456,10,95,Class2,18.456,665,90223.833,Class2,18.46,615,148515.375,Class2,18.456,607,93065.502,Class3,18.461,580,124602.976,Class3,18.456,705,146399.774,Class3,18.452,538,120021.385,Class4,18.456,675,108694.784,Class4,18.456,685,115500.878,Class4,18.456,599,92847.381
"3-Hexanol, 2,5-dimethyl-",265,534.2727,18.529,12,147,Class2,18.527,464,16768.488,Class2,18.532,486,15133.203,Class2,18.527,519,16061.609,Class3,18.527,549,20457.344,Class3,18.531,0,16469.483,Class3,18.532,604,18155.031,Class4,18.527,468,18194.802,Class4,18.527,483,18197.438,Class4,18.532,592,17092.332
"Silane, (1,1-dimethylethyl)(3,7-dimethyl-1-oxo-3,6-octadienyl)dimethyl-, (E)-",266,560.8889,18.594,9,115,Class2,18.585,557,32203.781,Class2,18.594,448,20066.175,Class2,18.594,665,42402.422,,0,0,,Class3,18.594,654,31848.306,Class3,18.589,521,26699.812,Class4,18.603,542,18568.597,Class4,18.594,539,43670.441,,0,0,
"Acetic acid, octyl ester",267,595.6,18.705,6,84,Class2,18.7,567,17838.34,,0,0,,Class2,18.7,440,10280.242,,0,0,,,0,0,,,0,0,,Class4,18.714,587,33009.939,,0,0,,Class4,18.691,0,11423.639
"7-Octenal, 3,7-dimethyl-",268,546.6,18.726,6,95,Class2,18.727,595,24935.722,Class2,18.731,0,41636.531,Class2,18.722,491,11923.473,Class3,18.723,631,21307.222,Class3,18.727,407,14945.158,Class3,18.727,609,36064.193,,0,0,,,0,0,,,0,0,
"Chroman-4-one, 2,3-dehydro-3-hydroxy-2-(4-dimethylaminophenyl)-",269,650.6667,18.917,3,281,,0,0,,,0,0,,,0,0,,,0,0,,Class3,18.918,602,6567.079,,0,0,,Class4,18.918,682,5958.157,,0,0,,Class4,18.914,668,5779.672
"Heptenyl angelate, 4Z-",270,743.8889,18.967,9,96,Class2,18.967,762,262679.195,Class2,18.967,747,791552.15,Class2,18.967,762,571216.206,Class3,18.967,774,619710.304,Class3,18.967,798,1134671.17,Class3,18.967,793,442973.454,Class4,18.967,661,202509.414,Class4,18.967,634,579490.245,Class4,18.971,764,161199.563
"Butyramide, 2,2,3,3-tetramethyl-",271,685.2,18.993,6,69,Class2,18.993,0,425605.196,Class2,18.998,701,620747.918,,0,0,,Class3,18.994,717,636978.906,,0,0,,Class3,18.989,753,502313.532,Class4,18.994,680,584183.716,,0,0,,Class4,18.989,575,352786.043
unknown,272,738.6364,19.007,12,130,Class2,19.016,754,30540103.1,Class2,19.02,742,38239450.4,Class2,19.025,0,44556157.1,Class3,19.02,736,40223553.2,Class3,19.007,763,21548382.3,Class3,19.007,755,23477961.5,Class4,19.02,748,38210969.9,Class4,18.994,751,3139611.14,Class4,19.002,754,16890109.7
"Ethanol, 2,2'-[1,2-ethanediylbis(oxy)]bis-, diacetate",273,810.75,19.03,4,161,Class2,19.038,656,98355.526,Class2,19.047,999,230910.108,Class2,18.993,589,22107.741,Class3,19.043,999,292851.438,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"2,4-Heptadienal, (E,E)-",274,691.1111,19.048,9,161,,0,0,,Class2,19.118,552,157697.04,Class2,19.047,656,10453.299,,0,0,,Class3,19.038,747,260814.193,,0,0,,Class4,19.047,749,341461.006,Class4,19.043,647,138313.574,Class4,19.034,714,411258.952
Bis(N-methoxy-N-methylamino)methane,275,710.8333,19.082,12,74,Class2,19.091,692,93393909.1,Class2,19.087,717,42417514.6,Class2,19.082,709,22725138.1,Class3,19.087,690,61168112.6,Class3,19.082,708,33903893.4,Class3,19.078,712,36910113.1,Class4,19.082,724,17240824.4,Class4,19.082,712,22214572.3,Class4,19.078,706,18371860.3
"1,4-Benzenediamine, N,N-diethyl-",276,549.4444,19.124,9,149,Class2,19.131,543,226119.669,Class2,19.131,593,225981.122,Class2,19.122,584,226403.398,Class3,19.127,539,283574.222,Class3,19.118,577,344237.964,Class3,19.122,591,209448.661,Class4,19.127,469,157649.797,Class4,19.127,654,375008.888,,0,0,
"1-Hexanol, 2-ethyl-",277,822.5,19.143,12,57,Class2,19.144,0,3758622.27,Class2,19.145,833,3471733.1,Class2,19.14,826,3213960.4,Class3,19.145,808,3353486.59,Class3,19.144,0,3472067.42,Class3,19.14,827,3795944.78,Class4,19.145,782,4238879.36,Class4,19.145,835,3923921.47,Class4,19.145,839,5063704.31
"Butyl aldoxime, 2-methyl-, syn-",278,610.2,19.178,10,86,Class2,19.176,575,54477.644,,0,0,,Class2,19.18,729,73091.16,Class3,19.18,561,71148.255,Class3,19.176,675,71004.454,Class3,19.18,518,33666.352,Class4,19.18,679,70047.937,Class4,19.176,757,179484.875,,0,0,
unknown,279,545.75,19.238,5,116,Class2,19.238,443,50461.152,Class2,19.242,648,325304.9,,0,0,,,0,0,,Class3,19.238,476,95181.976,Class3,19.234,0,194849.89,,0,0,,Class4,19.238,616,231027.536,,0,0,
Decanal,280,743.0833,19.251,12,81,Class2,19.251,718,114997.546,Class2,19.256,636,133054.026,Class2,19.251,720,241663.978,Class3,19.251,703,283324.074,Class3,19.251,679,124648.39,Class3,19.247,760,141422.763,Class4,19.256,711,92960.581,Class4,19.256,723,219618.882,Class4,19.251,675,93489.3
"Cyclotetrasiloxane, octamethyl-",281,877.6667,19.289,12,281,Class2,19.287,880,915918.397,Class2,19.287,881,1257190.34,Class2,19.291,895,710956.378,Class3,19.287,880,874212.458,Class3,19.287,880,948215.798,Class3,19.291,879,686206.076,Class4,19.287,884,1177006.57,Class4,19.287,875,780620.445,Class4,19.291,867,1045158.75
Valpromide,282,506.375,19.311,11,101,Class2,19.309,563,130044.165,Class2,19.313,477,60257.263,Class2,19.309,568,266078.885,Class3,19.313,0,172211.845,Class3,19.309,498,59523.966,Class3,19.309,523,76079.299,Class4,19.313,0,65132.28,Class4,19.313,0,111735.416,Class4,19.309,456,61993.518
Pentadecane,283,697.8333,19.324,12,85,Class2,19.327,680,141407.975,Class2,19.327,678,90560.959,Class2,19.318,681,110054.647,Class3,19.322,783,202613.781,Class3,19.322,609,63907.6,Class3,19.318,647,127483.051,Class4,19.327,631,103732.632,Class4,19.327,751,152650.484,Class4,19.322,757,125896.064
"cis-2,4-Dimethylthiane, S,S-dioxide",284,576.6667,19.417,3,83,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"2-Butanol, 3-methoxy-",285,588.75,19.436,12,59,Class2,19.438,631,1286775.24,Class2,19.433,628,662441.394,Class2,19.438,612,1230595.66,Class3,19.438,624,737644.563,Class3,19.438,555,651226.043,Class3,19.438,562,1185346.26,Class4,19.438,576,866652.541,Class4,19.433,653,2889443.43,Class4,19.433,595,934476.124
unknown,286,547.7,19.51,10,73,Class2,19.509,574,30689.301,Class2,19.509,597,20578.859,Class2,19.509,502,30258.934,Class3,19.509,482,32038.201,Class3,19.509,476,30783.654,Class3,19.509,574,28120.394,Class4,19.509,538,25940.599,,0,0,,Class4,19.509,546,29786.092
1-(Dimethylamino)pyrrole,287,588.6,19.525,5,110,Class2,19.522,660,12942.493,,0,0,,,0,0,,,0,0,,Class3,19.518,678,23702.139,Class3,19.527,507,11958.598,Class4,19.531,564,8452.521,Class4,19.527,534,10153.036,,0,0,
"Formic acid, trans-4-methylcyclohexyl ester",288,736.2727,19.477,11,81,Class2,19.469,775,351780.879,Class2,19.469,762,391849.827,Class2,19.469,740,431692.222,Class3,19.469,796,638770.623,Class3,19.469,762,378009.409,Class3,19.469,674,294809.265,Class4,19.469,813,356873.192,Class4,19.469,789,806790.901,Class4,19.469,780,464254.473
2-Amino-4-trimethylsilylbenzoic acid,289,529.1667,19.604,6,108,,0,0,,Class2,19.602,513,5093.613,,0,0,,Class3,19.602,464,12337.119,,0,0,,Class3,19.593,492,4607.732,Class4,19.602,536,12043.211,,0,0,,Class4,19.615,535,14078.199
Phenyl-pentamethyl-disiloxane,290,687.5,19.619,12,193,Class2,19.62,688,5548812.87,Class2,19.62,712,5096239.36,Class2,19.62,660,5730162.34,Class3,19.62,689,5373021.57,Class3,19.62,678,5238153.62,Class3,19.62,689,4876927.33,Class4,19.62,703,4663219.25,Class4,19.62,693,4808703.46,Class4,19.62,682,4901158.94
"Alanine, 2TMS derivative",291,549.3,19.64,11,43,Class2,19.642,571,763351.983,Class2,19.642,587,351049.846,Class2,19.642,583,1203658.97,Class3,19.642,545,1126761.77,Class3,19.638,0,266329.807,Class3,19.638,536,461601.044,Class4,19.642,598,343548.819,Class4,19.638,508,308651.972,Class4,19.642,511,376213.915
"3-Isopropoxy-1,1,1,7,7,7-hexamethyl-3,5,5-tris(trimethylsiloxy)tetrasiloxane",292,723.75,19.651,12,281,Class2,19.651,755,574160.3,Class2,19.651,707,543308.508,Class2,19.651,734,560135.406,Class3,19.651,703,530410.457,Class3,19.651,749,596762.898,Class3,19.651,749,526798.419,Class4,19.651,594,522242.231,Class4,19.651,742,504733.69,Class4,19.651,725,590551.394
Dihydrotomatidine,293,642,19.647,4,98,,0,0,,Class2,19.611,731,12142.68,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,19.691,620,3200.601
Benzaldehyde,294,940.0833,19.735,12,106,Class2,19.735,956,2967570.75,Class2,19.74,958,4425198.96,Class2,19.735,954,14334175.2,Class3,19.735,953,7589683.52,Class3,19.735,942,7904178.85,Class3,19.731,946,4252275.52,Class4,19.735,951,2956143.99,Class4,19.735,950,3590460.61,Class4,19.735,929,1030222.01
"3,5-Octadien-2-one, (E,E)-",295,625.4,19.747,5,95,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,19.749,497,45819.02,,0,0,,Class4,19.749,556,117010.637,,0,0,
"Butanoic acid, 3-hydroxy-, ethyl ester",296,661.6,19.766,7,88,Class2,19.766,608,99801.058,Class2,19.766,0,111871.803,,0,0,,Class3,19.767,599,77634.093,Class3,19.766,687,125657.876,Class3,19.767,715,140060.432,Class4,19.767,699,198390.537,,0,0,,Class4,19.766,0,85134.926
"1H-Pyrazole, 4-(trimethylsilyl)-",297,444.5,19.794,4,125,Class2,19.797,385,30555.118,,0,0,,Class2,19.797,466,20273.288,,0,0,,Class3,19.793,445,18593.195,Class3,19.789,482,25526.434,,0,0,,,0,0,,,0,0,
"2,3-Butanediol, diacetate",298,773.2727,19.932,12,87,Class2,19.935,772,35220924,Class2,19.935,778,51052102.3,Class2,19.94,785,74436935.4,Class3,19.935,776,50165372.5,Class3,19.931,773,31708498.3,Class3,19.931,768,35267968.4,Class4,19.94,777,57964059.1,Class4,19.926,0,3792476.09,Class4,19.931,775,21547219.8
"Ethanol, 2-(methylthio)-",299,741.3333,20.006,12,92,Class2,20.006,774,12454362.2,Class2,20.006,767,13279235,Class2,20.006,759,6747832.47,Class3,20.006,779,16277885.3,Class3,20.006,762,15245757,Class3,20.006,760,11819032.4,Class4,20.006,772,5723176.89,Class4,20.006,772,15878926.4,Class4,20.006,770,5394047.52
unknown,300,715.1818,20.043,11,281,Class2,20.033,832,6803.911,Class2,20.042,786,10849.942,Class2,20.042,545,6199.45,Class3,20.046,645,6897.923,Class3,20.046,745,8214.692,Class3,20.042,754,5820.979,Class4,20.042,761,9034.3,Class4,20.042,509,6007.937,Class4,20.046,739,14706.641
"1H-Imidazole, 1-methyl-5-nitro-",301,666.75,20.111,4,127,,0,0,,,0,0,,,0,0,,Class3,20.109,589,3468.526,,0,0,,,0,0,,,0,0,,Class4,20.113,859,6441.054,Class4,20.108,457,3676.453
"2-Nonenal, (E)-",302,783,20.138,3,70,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,20.135,713,397477.799,,0,0,,,0,0,,,0,0,
unknown,303,696.4167,20.145,12,126,Class2,20.144,717,1480840.6,Class2,20.144,719,1428768.45,Class2,20.144,742,1554572.6,Class3,20.144,711,1431334.31,Class3,20.148,726,1492569.05,Class3,20.144,718,1306327.54,Class4,20.149,700,1253706.29,Class4,20.144,712,1311635.26,Class4,20.148,584,1278053.33
"Octadecanoic acid, 1-[(tetradecyloxy)carbonyl]pentadecyl ester",304,549.5,20.159,10,98,Class2,20.162,591,273398.272,Class2,20.162,583,176042.679,Class2,20.157,500,123852.381,Class3,20.157,551,142538.727,Class3,20.157,435,110694.048,Class3,20.153,439,256752.011,Class4,20.157,602,215650.513,Class4,20.157,622,456891.719,Class4,20.162,582,252686.508
"3,3-Dimethylbutyl propylphosphonofluoridate",305,635.1667,20.259,6,127,,0,0,,Class2,20.286,614,6282.07,,0,0,,Class3,20.229,683,3290.744,Class3,20.237,556,8362.5,Class3,20.295,557,3969.944,,0,0,,,0,0,,Class4,20.291,658,7837.514
unknown,306,756.3636,20.276,12,126,Class2,20.273,769,448116.354,Class2,20.277,753,388524.327,Class2,20.277,748,503764.908,Class3,20.277,771,460216.666,Class3,20.277,749,429957.408,Class3,20.269,0,404837.968,Class4,20.273,763,288169.512,Class4,20.286,732,358226.944,Class4,20.277,765,391738.203
"Isophthalic acid, di(2-isopropylphenyl) ester",307,619.7778,20.282,9,139,Class2,20.277,680,16404.768,Class2,20.273,524,5347.437,Class2,20.295,575,9564.84,,0,0,,,0,0,,Class3,20.291,644,16931.293,Class4,20.286,565,14255.621,Class4,20.26,662,3588.098,Class4,20.264,604,2587.081
"1,3-Propanediol, 2-((acetyloxy)methyl)-2-ethyl-, diacetate",308,471.75,20.363,5,103,,0,0,,Class2,20.366,457,42524.46,Class2,20.362,0,25843.052,Class3,20.366,539,38168.984,,0,0,,Class3,20.366,448,22883.125,,0,0,,,0,0,,Class4,20.353,443,4946.076
"Methyl 3,4-ethylidene-D-galactopyranoside",309,478.7273,20.401,12,101,Class2,20.406,478,784258.427,Class2,20.402,444,582459.375,Class2,20.402,0,585882.019,Class3,20.402,481,533854.308,Class3,20.402,502,417281.869,Class3,20.397,484,367739.129,Class4,20.402,499,750530.316,Class4,20.402,492,423167.477,Class4,20.402,443,401208.616
"1,2-Ethanediol, dipropanoate",310,551.5556,20.436,9,57,Class2,20.437,571,1055366.3,,0,0,,Class2,20.437,561,479933.37,Class3,20.437,534,454967.195,,0,0,,Class3,20.433,494,313427.95,,0,0,,Class4,20.437,595,74020.352,Class4,20.433,555,497432.982
"Nadolol, 3TMS derivative",311,533.5556,20.456,10,116,Class2,20.459,597,147892.304,Class2,20.446,490,24586.227,Class2,20.45,490,41828.436,Class3,20.468,475,47741.429,Class3,20.446,523,6538.329,Class3,20.46,0,45738.497,Class4,20.446,525,73903.562,,0,0,,,0,0,
unknown,312,484.6667,20.499,5,74,,0,0,,Class2,20.499,569,26522.851,,0,0,,,0,0,,Class3,20.499,515,22373.096,Class3,20.499,0,62959.236,Class4,20.499,0,90221.381,,0,0,,Class4,20.499,370,27580.453
"1,6-Nonadien-3-ol, 3,7-dimethyl-",313,523,20.546,5,93,,0,0,,,0,0,,Class2,20.548,590,12353.768,,0,0,,,0,0,,Class3,20.548,495,7897.451,Class4,20.544,507,19225.223,,0,0,,Class4,20.544,535,20331.749
unknown,314,495.1667,20.641,6,57,Class2,20.637,485,28960.392,,0,0,,Class2,20.637,411,16406.086,,0,0,,Class3,20.646,577,19367.596,,0,0,,Class4,20.646,525,12488.671,Class4,20.637,456,40324.943,Class4,20.642,517,19168.595
"1-[2,4-Bis(trimethylsiloxy)phenyl]-2-[(4-trimethylsiloxy)phenyl]propan-1-one",315,578,20.682,6,281,Class2,20.681,518,11451.775,Class2,20.682,0,14564.882,,0,0,,,0,0,,Class3,20.681,635,13805.645,Class3,20.682,586,7772.639,Class4,20.677,611,16504.369,,0,0,,Class4,20.686,540,14146.78
"Thiophene, 3-nitro-2-(2-thienylsulfonyl)-",316,464.4,20.718,5,88,Class2,20.717,389,7113.178,,0,0,,,0,0,,Class3,20.726,408,11376.53,,0,0,,Class3,20.704,534,1514.862,,0,0,,Class4,20.722,441,14312.035,Class4,20.721,550,7573.286
unknown,317,518.6667,20.726,3,88,,0,0,,,0,0,,Class2,20.726,552,21859.113,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
unknown,318,576.7273,20.763,12,107,Class2,20.77,589,67797.108,Class2,20.766,584,41553.237,Class2,20.766,550,46146.146,Class3,20.775,540,65904.582,Class3,20.761,506,37185.726,Class3,20.757,540,57508.063,Class4,20.762,605,61377.558,Class4,20.766,693,66549.988,Class4,20.757,565,63779.24
"2-Cyclohexen-1-ol, 2,4,4-trimethyl-",319,648.3,20.782,10,124,,0,0,,Class2,20.788,732,46967.805,Class2,20.784,576,35394.664,Class3,20.784,670,55865.694,,0,0,,Class3,20.779,662,85485.245,Class4,20.784,615,65048.878,Class4,20.779,690,148790.059,Class4,20.77,588,95144.407
unknown,320,401.5,20.813,3,281,,0,0,,,0,0,,Class2,20.815,389,16476.334,Class3,20.81,0,11072.446,Class3,20.815,414,10893.404,,0,0,,,0,0,,,0,0,,,0,0,
1-Octanol,321,822.1818,20.839,12,56,Class2,20.837,742,1136998.34,Class2,20.841,767,1381754.31,Class2,20.837,841,1369072.93,Class3,20.837,846,1583089.23,Class3,20.837,838,1655148.84,Class3,20.837,785,655558.768,Class4,20.837,823,1914518.63,Class4,20.842,0,2503010.37,Class4,20.841,862,2765638.48
"Androst-5-en-17-one, 3-hydroxy-16,16-dimethoxy-, (3-",322,522,20.882,11,88,Class2,20.881,534,2466098.51,Class2,20.881,531,4609002.86,Class2,20.886,545,6365593.1,Class3,20.882,0,4999920.79,Class3,20.881,513,3293649.92,Class3,20.882,0,4584875.55,Class4,20.882,0,6560775.85,Class4,20.882,0,567278.613,Class4,20.881,551,1921855.18
"Propanedioic acid, (acetylamino)-, diethyl ester",323,513.3333,20.905,9,144,Class2,20.904,506,66243.714,Class2,20.908,579,46868.635,Class2,20.908,449,33201.644,Class3,20.904,532,29367.452,Class3,20.908,570,32560.933,Class3,20.904,505,55501,Class4,20.908,527,98088.826,Class4,20.899,506,10952,Class4,20.904,446,38252.6
"3-Methyl-6-ethyl--2,4-dioxadecane",324,490.2,20.914,5,59,,0,0,,,0,0,,Class2,20.917,398,160696.721,,0,0,,,0,0,,,0,0,,,0,0,,Class4,20.913,595,402466.379,,0,0,
3-(Methylthio)propanoic acid ethyl ester,325,674.7143,20.932,7,148,Class2,20.93,844,1000252.53,,0,0,,,0,0,,Class3,20.935,746,104223.317,Class3,20.93,785,367673.619,Class3,20.926,780,575147.492,Class4,20.93,481,52074.304,,0,0,,Class4,20.93,567,66615.659
"Glutaric acid, tridec-2-yn-1-yl dodecyl ester",326,551.8889,20.989,9,115,Class2,20.988,526,96887.4,Class2,20.992,543,116106.414,Class2,20.992,569,84204.676,Class3,20.988,564,90082.88,Class3,20.983,521,107676.515,Class3,20.984,579,64466.166,Class4,20.993,547,72675.208,Class4,20.988,576,82778.514,Class4,20.992,542,53140.141
"3,5-Octadien-2-one",327,620.3333,20.989,3,95,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
unknown,328,588,21.068,5,70,Class2,21.072,528,33291.822,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,21.064,619,37855.907,,0,0,
Methyl-methoxy-hydroxymethyl-amine,329,634.1818,21.116,12,74,Class2,21.117,633,645976.365,Class2,21.117,707,1211388.1,Class2,21.117,688,1826206.1,Class3,21.117,573,993362.683,Class3,21.117,688,696728.947,Class3,21.117,664,785127.594,Class4,21.117,676,1123248.32,Class4,21.112,0,541958.91,Class4,21.117,657,896601.224
Isobutyl (3-(methylthio)propyl) carbonate,330,572.6667,21.197,12,88,Class2,21.197,586,9730106.09,Class2,21.197,596,17975892.8,Class2,21.201,585,19494558.6,Class3,21.201,595,20417362.1,Class3,21.197,595,14609389,Class3,21.197,595,14704606.5,Class4,21.197,593,21148918.5,Class4,21.192,570,2040041.02,Class4,21.197,562,6700701.94
"Acetic acid, nonyl ester",331,592,21.255,12,69,Class2,21.25,498,540306.286,Class2,21.255,475,457582.679,Class2,21.254,508,209386.979,Class3,21.25,486,313729.297,Class3,21.25,521,340000.51,Class3,21.25,505,347196.077,Class4,21.255,470,733048.424,Class4,21.264,770,111237.665,Class4,21.259,604,408329.871
"Silane, dimethyl(dimethyl(dimethyl(2-isopropylphenoxy)silyloxy)silyloxy)(2-isopropylphenoxy)-",332,664,21.286,12,163,Class2,21.286,683,211281.024,Class2,21.286,680,206619.162,Class2,21.281,669,219318.475,Class3,21.286,676,200960.94,Class3,21.286,0,198203.911,Class3,21.281,690,157535.217,Class4,21.29,659,162745.649,Class4,21.286,656,159472.456,Class4,21.29,677,185202.085
unknown,333,587.25,21.292,4,147,Class2,21.272,523,2267.155,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,21.299,479,13917.841,,0,0,
unknown,334,509.4,21.307,5,161,Class2,21.317,533,59827.533,,0,0,,,0,0,,Class3,21.299,422,35919.289,Class3,21.308,462,16950.031,Class3,21.299,534,38635.14,,0,0,,,0,0,,Class4,21.312,596,89609.259
"Ethane-1,1-diol dipropanoate",335,565.875,21.339,8,144,Class2,21.339,632,39605.148,Class2,21.339,577,36167.848,Class2,21.339,631,41610.828,Class3,21.343,567,33249.423,Class3,21.334,445,14030.261,Class3,21.343,526,22143.889,Class4,21.339,515,52647.414,,0,0,,Class4,21.334,634,32888.334
"2,6-Nonadienal, (E,E)-",336,723.0909,21.373,12,70,Class2,21.374,754,1913543.82,Class2,21.374,0,889236.737,Class2,21.365,611,77769.931,Class3,21.375,601,138039.565,Class3,21.374,709,505068.643,Class3,21.37,761,1716262.38,Class4,21.375,753,1393857.92,Class4,21.375,777,2702161.86,Class4,21.37,717,661137.215
"Phosphonoacetic Acid, 3TMS derivative",337,631.8182,21.445,12,163,Class2,21.445,651,239281.677,Class2,21.446,648,254536.655,Class2,21.445,638,304937.75,Class3,21.446,650,291546.836,Class3,21.445,650,309573.612,Class3,21.446,641,230095.347,Class4,21.441,573,215585.04,Class4,21.446,647,258757.788,Class4,21.446,0,224244.826
2-Ethylthiacyclohexane,338,470.75,21.49,12,101,Class2,21.49,486,98175.9,Class2,21.49,428,97311.078,Class2,21.49,508,105039.585,Class3,21.49,518,106533.344,Class3,21.49,481,76540.82,Class3,21.486,436,75640.176,Class4,21.49,464,90401.426,Class4,21.486,499,93768.239,Class4,21.49,437,66089.542
unknown,339,464.8,21.554,10,102,Class2,21.556,479,131449.211,Class2,21.557,495,90620.787,Class2,21.552,464,93960.007,Class3,21.552,458,60527.124,Class3,21.552,428,51316.971,Class3,21.552,554,104216.138,Class4,21.557,548,202904.875,Class4,21.557,380,15799.584,Class4,21.552,502,100547.265
"3-Octen-1-ol, (Z)-",340,692.25,21.587,5,81,,0,0,,Class2,21.592,729,45078.991,Class2,21.588,0,84630.883,Class3,21.583,728,57475.756,Class3,21.588,750,94071.129,,0,0,,,0,0,,Class4,21.583,562,19556.239,,0,0,
unknown,341,643.7273,21.611,11,147,Class2,21.61,673,10634.805,Class2,21.61,532,9597.485,Class2,21.61,719,12322.29,,0,0,,Class3,21.61,677,11951.814,Class3,21.61,668,11043.412,Class4,21.61,656,10225.757,Class4,21.614,653,9268.534,Class4,21.61,502,11947.968
"2,4-Diacetoxypentane",342,562.0833,21.703,12,86,Class2,21.703,586,184559.675,Class2,21.703,633,255242.287,Class2,21.699,627,281099.192,Class3,21.703,610,275534.066,Class3,21.699,600,182968.756,Class3,21.699,552,265775.189,Class4,21.703,563,193923.075,Class4,21.703,617,232284.749,Class4,21.703,552,172097.634
"3-Octenoic acid, TMS derivative",343,641.1,21.722,11,73,Class2,21.721,684,1651413.42,Class2,21.721,621,729149.002,Class2,21.725,681,714146.238,Class3,21.725,0,516049.85,,0,0,,Class3,21.721,669,1053697.35,Class4,21.721,664,1126134.88,Class4,21.717,654,1285054.92,Class4,21.721,614,1442294.63
"Pentasiloxane, 1,1,3,3,5,5,7,7,9,9-decamethyl-",344,581.5556,21.75,9,281,Class2,21.747,529,68248.227,Class2,21.752,567,75703.948,Class2,21.747,532,54196.346,Class3,21.752,571,70813.296,,0,0,,Class3,21.752,469,56236.403,Class4,21.752,610,72141.068,,0,0,,,0,0,
"Cyclohexanol, 2,6-dimethyl-",345,603,21.766,12,128,Class2,21.765,600,398667.344,Class2,21.765,628,383517.994,Class2,21.765,598,420638.803,Class3,21.761,616,413979.432,Class3,21.765,626,287637.931,Class3,21.774,579,429823.806,Class4,21.765,616,311261.841,Class4,21.765,598,660238.204,Class4,21.761,667,417133.489
unknown,346,694,21.794,7,57,Class2,21.783,692,546303.652,Class2,21.801,673,456337.857,,0,0,,Class3,21.792,783,600345.062,,0,0,,,0,0,,Class4,21.801,627,477754.516,,0,0,,,0,0,
"5-Octen-1-ol, (Z)-",347,747.9167,21.84,12,81,Class2,21.841,821,624582.673,Class2,21.841,788,700050.536,Class2,21.836,810,448864.302,Class3,21.841,779,589193.175,Class3,21.841,809,1691548.77,Class3,21.841,796,579782.999,Class4,21.841,761,689065.874,Class4,21.841,775,722775.13,Class4,21.841,791,474602.527
"Cyclopentanecarboxylic acid, 1-phenyl-, 2-(diethylamino)ethyl ester",348,475,21.913,3,115,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"Fumaric acid, di(cis-non-3-enyl) ester",349,678.6667,21.938,9,124,,0,0,,Class2,21.939,841,28519.949,,0,0,,Class3,21.943,481,7340.194,Class3,21.939,671,26236.8,Class3,21.934,689,12400.124,Class4,21.939,536,24784.127,Class4,21.934,531,16724.282,,0,0,
"Glutaric acid, tridec-2-yn-1-yl neopentyl ester",350,471.4,22.029,5,115,Class2,22.018,467,12294.726,Class2,22.014,505,15713.266,,0,0,,,0,0,,,0,0,,Class3,22.014,481,10405.167,Class4,22.019,439,21080.647,,0,0,,Class4,22.081,465,65047.574
1-Methylcycloheptanol,351,453.2222,22.043,10,113,Class2,22.045,448,20629.642,,0,0,,Class2,22.05,0,22360.861,Class3,22.041,409,18463.007,Class3,22.036,519,14149.337,Class3,22.036,482,22135.352,Class4,22.045,415,16212.784,Class4,22.045,486,33667.662,Class4,22.05,453,17497.348
"1,3-Dioxolane, 4,4,5-trimethyl-2-pentadecyl-",352,529.4,22.091,10,115,Class2,22.09,543,139417.225,Class2,22.094,553,102629.108,Class2,22.09,539,137180.929,Class3,22.09,552,116189.222,Class3,22.09,533,94234.87,Class3,22.09,534,59402.113,Class4,22.094,578,72679.344,Class4,22.085,507,88143.854,Class4,22.09,451,65047.574
"1,2-Propanediol, 2-acetate",353,651.6667,22.156,12,75,Class2,22.156,639,122128.301,Class2,22.152,665,123075.954,Class2,22.156,639,225606.789,Class3,22.152,663,156230.594,Class3,22.156,610,80836.426,Class3,22.156,662,102497.533,Class4,22.156,640,176406.698,Class4,22.156,635,69308.141,Class4,22.156,609,90683.42
Cyclohexaneethanol,354,693.6667,22.222,10,67,Class2,22.227,650,440711.029,Class2,22.223,719,460213.761,Class2,22.227,695,328798.035,Class3,22.223,685,475240.172,Class3,22.223,750,442246.954,Class3,22.219,0,444262.62,Class4,22.219,764,475602.462,Class4,22.227,701,788064.797,Class4,22.227,671,610123.026
"1-Cyclohexene-1-carboxaldehyde, 2,6,6-trimethyl-",355,818.5833,22.207,12,152,Class2,22.209,833,504762.03,Class2,22.205,796,386688.668,Class2,22.205,838,414391.42,Class3,22.21,767,405795.274,Class3,22.205,792,309503.473,Class3,22.201,825,505819.405,Class4,22.21,736,384469.145,Class4,22.21,866,920337.532,Class4,22.205,854,666823.978
"Megastigma-4,6(Z),8(E)-triene",356,622.7143,22.245,8,161,Class2,22.245,683,122581.805,Class2,22.258,0,70416.769,Class2,22.241,637,56033.631,Class3,22.25,589,67680.413,Class3,22.232,478,15139.102,Class3,22.236,622,105733.194,,0,0,,Class4,22.254,618,91018.925,Class4,22.245,732,158564.508
N-{2-(2-Chlorophenyl)-2-[(trimethylsilyl)oxy]ethyl}propan-2-amine,357,509,22.272,6,45,Class2,22.276,461,152164.208,,0,0,,Class2,22.272,525,120747.057,,0,0,,Class3,22.267,555,103351.239,Class3,22.276,523,102484.267,,0,0,,,0,0,,,0,0,
"1,3-Butanediol, diacetate",358,802.5833,22.294,12,43,Class2,22.294,812,2709255.9,Class2,22.294,831,1757835.96,Class2,22.294,819,2708177.12,Class3,22.294,816,2332706.59,Class3,22.294,811,1139598.47,Class3,22.294,829,1929142.27,Class4,22.294,740,1684694.84,Class4,22.294,811,1701305.13,Class4,22.294,806,1761119.36
unknown,359,584,22.338,8,147,Class2,22.338,558,8126.744,,0,0,,Class2,22.338,604,7734.057,Class3,22.334,551,9870.322,Class3,22.338,715,6831.918,Class3,22.343,586,8581.078,Class4,22.338,467,9270.965,,0,0,,Class4,22.338,593,10243.873
"Benzene, 1-chloro-2-methoxy-",360,626.2,22.385,5,142,,0,0,,Class2,22.383,693,50038.622,Class2,22.387,580,29142.832,Class3,22.387,605,23250.459,Class3,22.383,670,70018.384,,0,0,,Class4,22.383,583,25337.035,,0,0,,,0,0,
3-(Methylthio)propyl acetate,361,768.6,22.421,12,88,Class2,22.423,815,1410037.63,Class2,22.423,756,397959.131,Class2,22.423,748,289300.366,Class3,22.423,790,662651.305,Class3,22.423,713,239257.342,Class3,22.418,648,166578.909,Class4,22.418,0,101640.175,Class4,22.418,0,113498.005,Class4,22.418,776,131929.248
"3-(1,4-Dioxa-8-aza-spiro[4.5]dec-8-ylmethyl)-5,8a-dimethyl-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-b]furan-2-one",362,522.1667,22.446,6,141,Class2,22.449,468,12109.887,Class2,22.441,500,19837.794,,0,0,,Class3,22.45,532,13724.737,Class3,22.445,484,12796.086,Class3,22.445,554,17831.471,Class4,22.45,595,28620.591,,0,0,,,0,0,
2-Methylbicyclo[3.2.1]octane,363,716.4,22.479,12,95,Class2,22.485,726,62577.456,Class2,22.485,744,100432.765,Class2,22.472,0,17715.596,Class3,22.476,662,26840.162,Class3,22.48,723,144320.66,Class3,22.467,590,28124.158,Class4,22.481,615,145704.748,Class4,22.485,729,86169.989,Class4,22.481,0,144340.8
"Ethane-1,2-diyl dipentanoate",364,550.8333,22.511,6,85,Class2,22.512,582,163087.07,Class2,22.516,512,65546.182,Class2,22.507,478,90068.272,,0,0,,,0,0,,Class3,22.507,565,76100.414,Class4,22.512,640,290359.804,,0,0,,Class4,22.512,528,55978.066
Diethyl 2-(N-(tert-butoxycarbonyl)amino)malonate,365,650.5714,22.52,8,57,Class2,22.52,652,234686.672,Class2,22.521,0,161112.38,Class2,22.52,678,162169.593,Class3,22.521,606,123560.004,,0,0,,Class3,22.516,741,144129.899,Class4,22.525,698,413097.076,Class4,22.521,497,15050.919,Class4,22.516,682,124022.331
"Hexa-1,3,5-triyne",366,729.8182,22.546,11,74,Class2,22.547,788,298486.789,Class2,22.547,722,290410.556,Class2,22.547,636,372389.287,Class3,22.547,811,312907.609,Class3,22.547,822,223151.527,Class3,22.547,719,186539.284,Class4,22.547,709,412119.497,Class4,22.543,711,234090.598,Class4,22.543,819,186514.346
unknown,367,661.5833,22.591,12,99,Class2,22.591,713,166532.523,Class2,22.592,643,66325.482,Class2,22.591,584,50683.839,Class3,22.587,750,68028.699,Class3,22.591,708,33184.214,Class3,22.592,682,280753.396,Class4,22.592,709,164625.75,Class4,22.592,720,311987.247,Class4,22.587,706,141982.595
Benzeneacetaldehyde,368,937.2727,22.626,12,91,Class2,22.627,955,591370.49,Class2,22.632,947,825519.936,Class2,22.623,0,844877.943,Class3,22.627,935,1219597.25,Class3,22.627,943,471499.07,Class3,22.627,927,1129987.3,Class4,22.627,935,989726.84,Class4,22.627,922,833138.05,Class4,22.627,936,1517414.18
"5,9-Undecadien-2-ol, 2,6,10-trimethyl-",369,610.2,22.654,10,123,Class2,22.658,625,41361.286,Class2,22.663,627,33365.49,Class2,22.649,632,43396.145,Class3,22.658,627,38902.971,Class3,22.654,664,47810.719,Class3,22.645,627,54923.497,Class4,22.658,578,34639.931,Class4,22.654,662,72988.45,Class4,22.649,629,103507.271
unknown,370,491,22.736,4,88,,0,0,,,0,0,,,0,0,,,0,0,,Class3,22.734,503,37641.3,Class3,22.734,490,30290.566,Class4,22.738,466,38331.932,Class4,22.738,505,22079.575,,0,0,
unknown,371,563.3,22.749,12,147,Class2,22.751,564,16897.043,Class2,22.747,488,15772.57,Class2,22.743,0,10715.968,Class3,22.752,573,15189.858,Class3,22.747,604,15261.343,Class3,22.747,631,16725.065,Class4,22.752,552,14293.372,Class4,22.752,491,15494.39,Class4,22.751,0,12990.375
"Cyclohexaneethanol, 4-methyl-methylene-",372,469.7143,22.779,7,112,Class2,22.774,558,8165.569,Class2,22.778,489,21035.908,,0,0,,Class3,22.783,450,15124.285,Class3,22.778,484,16788.272,Class3,22.778,436,12598.986,,0,0,,Class4,22.778,378,12501.422,,0,0,
"2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (E)-",373,666.6667,22.814,9,83,Class2,22.818,706,317073.467,Class2,22.814,627,98979.548,,0,0,,,0,0,,,0,0,,Class3,22.814,694,602563.703,Class4,22.814,708,302596.665,Class4,22.814,731,635061.499,Class4,22.814,672,196065.117
Acetophenone,374,909.5833,22.837,12,105,Class2,22.84,874,401913.073,Class2,22.836,901,363916.426,Class2,22.836,938,471236.077,Class3,22.836,916,471052.484,Class3,22.84,876,339664.355,Class3,22.836,920,456188.322,Class4,22.836,891,440138.145,Class4,22.836,924,431583.254,Class4,22.836,899,516351.918
"Cyclohexanol, 1-ethynyl-",375,602.1667,22.859,6,95,Class2,22.858,564,18430.877,Class2,22.858,615,30467.629,Class2,22.858,632,16417.995,Class3,22.863,648,13423.154,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
unknown,376,464.375,22.883,8,74,,0,0,,Class2,22.889,417,37260.358,Class2,22.885,368,40135.794,Class3,22.876,616,32454.637,Class3,22.885,423,29761.437,Class3,22.88,406,33904.872,Class4,22.885,570,42467.215,Class4,22.885,456,42019.519,Class4,22.88,459,34426.101
Ethyl 3-acetoxybutyrate,377,509.5556,22.917,9,129,Class2,22.92,510,27170.252,Class2,22.916,474,26333.14,Class2,22.916,478,29233.057,Class3,22.92,564,18749.053,Class3,22.916,535,21534.02,Class3,22.916,519,23700.088,Class4,22.92,562,38332.339,Class4,22.92,481,21701.501,Class4,22.907,463,21834.843
"Silanediol, dimethyl-",378,862,23.03,3,100,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,23.054,886,13617.077,Class4,23.049,805,20812.143,,0,0,
3-(Methoxymethoxy)butanoic acid,379,571.0833,23.015,12,103,Class2,23.018,605,744317.998,Class2,23.014,558,302609.983,Class2,23.013,563,653803.767,Class3,23.018,601,594399.663,Class3,23.018,552,206218.767,Class3,23.014,575,375986.075,Class4,23.014,507,270843.955,Class4,23.014,557,273770.731,Class4,23.014,591,382422.831
"Silanediol, dimethyl-",380,889.1818,23.033,12,77,Class2,23.031,926,50819496.1,Class2,23.036,893,46552658.8,Class2,23.036,898,62268396.6,Class3,23.031,0,54199260.5,Class3,23.031,923,55867603.6,Class3,23.036,924,58366245.1,Class4,23.036,904,46101275.1,Class4,23.036,881,47465199.6,Class4,23.027,793,46217466
"2,4-Dihydroxybenzaldehyde, 2TMS derivative",381,430.3333,23.108,3,99,Class2,23.107,414,13926.249,Class2,23.111,463,5772.728,,0,0,,,0,0,,,0,0,,,0,0,,Class4,23.107,414,10464.618,,0,0,,,0,0,
"(Z)6,(Z)9-Pentadecadien-1-ol",382,511.25,23.147,8,71,Class2,23.147,484,215552.093,Class2,23.147,477,161625.208,Class2,23.147,478,168379.284,Class3,23.147,462,157600.849,Class3,23.151,634,110475.755,Class3,23.142,477,109343.039,Class4,23.147,495,196061.716,Class4,23.147,583,14500.566,,0,0,
"2H-imidazole-2-thione, 1,3-dihydro-1-methyl-5-(1-methylethyl)-",383,610,23.175,9,141,Class2,23.182,446,21081.239,Class2,23.173,0,51270.625,Class2,23.178,599,50003.58,Class3,23.178,681,61141.131,Class3,23.173,613,87176.326,Class3,23.178,570,33918.106,Class4,23.174,711,53605.25,Class4,23.174,666,89540.531,Class4,23.169,594,14776.77
1-Hexadecyne,384,666.25,23.223,6,124,,0,0,,,0,0,,Class2,23.222,646,37469.809,Class3,23.227,662,24156.113,Class3,23.227,721,37468.053,Class3,23.214,0,10869.58,Class4,23.222,0,11331.143,Class4,23.227,636,17983.926,,0,0,
1-Nonanol,385,885,23.271,12,56,Class2,23.271,905,7816592.19,Class2,23.271,895,9021411.88,Class2,23.271,902,6209720,Class3,23.271,904,6063006.73,Class3,23.271,903,9740393.32,Class3,23.267,899,5351995.68,Class4,23.271,903,12471171.5,Class4,23.276,901,15680613.2,Class4,23.276,900,16625619.6
"1-(3,4-Methylenedioxyphenyl)-2-methylamino-1-butanone, N-trimethylsilyl-",386,561,23.316,3,87,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
unknown,387,674.1667,23.396,12,73,Class2,23.395,686,686254.63,Class2,23.396,662,672749.814,Class2,23.395,662,804928.543,Class3,23.396,667,345434.483,Class3,23.395,656,784930.078,Class3,23.396,642,644578.373,Class4,23.396,653,659044.139,Class4,23.387,655,675608.005,Class4,23.4,683,293579.625
"Carbonic acid, decyl undecyl ester",388,662,23.445,10,71,Class2,23.444,627,97423.505,Class2,23.453,684,48529.15,,0,0,,Class3,23.445,648,81707.518,Class3,23.44,713,100707.388,Class3,23.44,749,99862.339,Class4,23.449,506,107396.67,,0,0,,Class4,23.444,0,137245.23
"1,3-Benzodioxole",389,585.7,23.483,10,122,Class2,23.484,634,33896.137,Class2,23.48,508,22695.627,,0,0,,,0,0,,Class3,23.48,621,24064.318,Class3,23.485,539,32088.439,Class4,23.485,485,23744.015,Class4,23.485,689,52113.58,Class4,23.489,552,26632.395
"Cyclooctasiloxane, hexadecamethyl-",390,792.3333,23.596,12,147,Class2,23.595,805,157603.897,Class2,23.595,0,153428.592,Class2,23.595,782,148097.404,Class3,23.596,804,159932.302,Class3,23.595,802,212804.114,Class3,23.596,797,150418.781,Class4,23.596,789,146289.518,Class4,23.596,791,145680.87,Class4,23.595,0,140584.71
"3-(1,5-Dimethyl-hexa-1,4-dienyl)-2,2-dimethyl-4-trimethylsilylcyclopentanol",391,532.4286,23.623,7,69,Class2,23.622,554,82282.137,Class2,23.622,538,50924.805,Class2,23.622,533,29812.655,,0,0,,,0,0,,,0,0,,Class4,23.622,487,56177.08,,0,0,,,0,0,
1-Cyclohexyldimethylsilyloxyoctadecane,392,665.4,23.638,11,327,Class2,23.635,675,233759.347,Class2,23.635,0,229345.906,Class2,23.635,638,270014.535,Class3,23.636,658,230310.495,Class3,23.64,689,255238.578,Class3,23.636,655,218295.532,Class4,23.64,526,195385.655,Class4,23.64,735,213902.645,Class4,23.64,685,207744.182
"3-Nonen-1-ol, (Z)-",393,867.8333,23.798,12,68,Class2,23.8,896,1889468.02,Class2,23.8,896,5849345.41,Class2,23.795,890,3006929.13,Class3,23.8,899,4146346.25,Class3,23.8,902,6103995.3,Class3,23.795,902,3480726.27,Class4,23.8,897,2985815.57,Class4,23.8,893,4543436.72,Class4,23.795,897,2536701.64
"2,6,6-Trimethyl-2-cyclohexene-1,4-dione",394,523.2857,23.837,7,152,,0,0,,Class2,23.835,556,55881.163,Class2,23.835,642,94834.345,,0,0,,Class3,23.835,575,56394.587,Class3,23.84,551,28870.584,Class4,23.835,392,19955.875,,0,0,,,0,0,
Dihydro-3-methylene-5-methyl-2-furanone,395,619.3333,23.894,3,68,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
unknown,396,482.1111,23.917,9,88,Class2,23.915,440,95604.749,Class2,23.92,466,120384.661,Class2,23.92,512,161279.552,Class3,23.92,482,122390.512,Class3,23.915,492,124768.28,Class3,23.915,493,109559.797,Class4,23.92,434,97144.049,Class4,23.915,539,162665.18,Class4,23.915,481,108466.621
"1,3-Dioxolane-2,2-diethanol",397,567.3333,23.94,9,117,Class2,23.942,624,37489.83,Class2,23.942,587,21032.805,Class2,23.942,650,28009.425,,0,0,,,0,0,,Class3,23.938,567,27151.859,Class4,23.942,576,28867.136,Class4,23.942,587,21768.192,Class4,23.942,598,27214.632
"Borane, chlorodipropyl-",398,456.5,23.999,10,85,Class2,24,450,100736.401,Class2,24.004,430,81606.628,Class2,24,473,68990.464,Class3,24,432,52252.569,Class3,23.995,430,62340.117,Class3,24,467,94091.825,Class4,24,463,118265.358,Class4,24,463,44796.846,Class4,24,429,68190.459
"Ethanone, 1-(2-hydroxyphenyl)-",399,584.6667,24.016,3,113,Class2,24.017,540,14752.548,Class2,24.017,569,17155.917,,0,0,,,0,0,,,0,0,,,0,0,,Class4,24.013,645,15778.41,,0,0,,,0,0,
"Phosphoric acid, tris(2-ethylhexyl) ester",400,607.3333,24.049,3,99,,0,0,,Class2,24.053,502,62832.987,,0,0,,,0,0,,,0,0,,,0,0,,Class4,24.049,667,81044.993,Class4,24.044,653,29699.412,,0,0,
2-Methylheptanoic acid,401,636.6667,24.032,3,41,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
L-Terpineol,402,599,24.068,10,81,Class2,24.071,658,35838.692,,0,0,,Class2,24.066,586,22242.951,Class3,24.066,0,17839.586,,0,0,,Class3,24.066,577,33042.464,Class4,24.066,0,44629.756,Class4,24.075,582,58320.91,Class4,24.066,653,48504.39
unknown,403,722.6364,24.134,12,85,Class2,24.133,717,41369.948,Class2,24.137,738,37941.534,Class2,24.133,750,44473.301,Class3,24.133,798,62977.439,Class3,24.133,726,30131.902,Class3,24.133,737,48839.033,Class4,24.133,789,40935.647,Class4,24.138,0,44653.105,Class4,24.133,793,54284.044
"Pentanoic acid, 2-methyl-, methyl ester",404,464.8333,24.174,12,88,Class2,24.177,485,85477.356,Class2,24.177,393,21539.859,Class2,24.177,383,17884.778,Class3,24.169,362,26226.341,Class3,24.177,386,9489.456,Class3,24.169,527,88472.77,Class4,24.169,418,44820.243,Class4,24.173,468,76895.538,Class4,24.173,497,80322.545
"(S)-6,6-Dimethyl-2-azaspiro[4.4]non-1-ene",405,499,24.272,8,43,Class2,24.271,538,126836.439,Class2,24.275,491,215141.987,Class2,24.275,503,239793.432,Class3,24.275,495,206379.423,Class3,24.275,456,302438.781,,0,0,,Class4,24.266,525,152873.609,Class4,24.271,463,168712.749,Class4,24.271,521,288908.701
(6Z)-Nonen-1-ol,406,802.8889,24.285,9,67,Class2,24.288,742,162480.791,Class2,24.288,842,649652.515,Class2,24.284,749,555238.053,Class3,24.284,842,434901.917,Class3,24.288,843,1135595.55,Class3,24.284,758,131064.678,Class4,24.284,804,241795.516,Class4,24.284,804,333333.125,Class4,24.284,842,282163.354
o-Acetyl-L-serine,407,527.6667,24.339,3,60,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,24.324,473,108440.269,Class4,24.351,544,54461.879,Class4,24.342,566,47120.311,,0,0,
"1,7-Di(3-ethylphenyl)-2,2,4,4,6,6-hexamethyl-1,3,5,7-tetraoxa-2,4,6-trisilaheptane",408,725.75,24.408,4,73,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,24.413,652,60577.619,,0,0,,,0,0,,,0,0,
"1-Propanol, 3-(methylthio)-",409,767,24.471,12,106,Class2,24.47,0,9228117.4,Class2,24.471,815,8663228.68,Class2,24.47,726,4184059.17,Class3,24.471,751,7452110.82,Class3,24.47,0,7607853.12,Class3,24.471,767,5660053.07,Class4,24.471,794,3404058.7,Class4,24.471,753,8931157.12,Class4,24.471,796,3189984.37
1-Cyclohexyl-1-pentanol,410,513.3333,24.481,4,101,Class2,24.488,470,6513.796,Class2,24.479,0,15305.78,,0,0,,,0,0,,,0,0,,,0,0,,Class4,24.48,488,13175.35,,0,0,,Class4,24.475,582,18470.461
(6Z)-Nonen-1-ol,411,809.4545,24.545,12,67,Class2,24.542,837,3002428.55,Class2,24.546,859,5865899.56,Class2,24.542,0,2033970.67,Class3,24.546,866,2446767.81,Class3,24.546,863,14189587.2,Class3,24.542,803,1089344.83,Class4,24.546,860,8764895.22,Class4,24.546,857,11977278.8,Class4,24.546,857,15245520
"Hexanoic acid, undec-2-enyl ester",412,564.5,24.554,6,99,Class2,24.555,583,736620.661,,0,0,,,0,0,,Class3,24.551,433,244810.517,,0,0,,Class3,24.555,638,1068212.9,,0,0,,,0,0,,,0,0,
4-Methyl-2-pentyl acetate,413,469.375,24.617,8,144,Class2,24.617,448,14428.726,Class2,24.626,514,5904.889,Class2,24.613,500,18441.14,Class3,24.617,512,25940.289,Class3,24.617,369,3132.597,Class3,24.617,487,16795.077,Class4,24.613,452,10220.281,,0,0,,Class4,24.617,473,11034.79
"Acetic acid, phenylmethyl ester",414,812.75,24.686,12,108,Class2,24.688,851,143804.407,Class2,24.688,672,79883.541,Class2,24.684,682,58437.291,Class3,24.688,768,57172.173,Class3,24.684,779,109116.035,Class3,24.684,790,76869.133,Class4,24.684,823,73555.419,Class4,24.688,794,83987.263,Class4,24.684,758,79781.115
unknown,415,778.5,24.753,5,67,,0,0,,Class2,24.755,786,157686.79,Class2,24.75,717,185038.408,Class3,24.755,792,124878.775,Class3,24.755,819,263595.124,Class3,24.751,0,27948.545,,0,0,,,0,0,,,0,0,
Citral,416,682.4444,24.773,9,69,Class2,24.773,729,171701.223,Class2,24.777,674,58039.787,,0,0,,,0,0,,,0,0,,Class3,24.768,712,88183.589,Class4,24.773,655,91990.687,Class4,24.768,492,84879.732,Class4,24.773,636,63760.425
"4a,8a-(Methaniminomethano)naphthalene-9,11-dione, 10-phenyl-",417,604.6,24.851,10,128,Class2,24.852,571,26477.563,Class2,24.853,629,27425.246,Class2,24.857,661,28974.554,Class3,24.848,554,25615.994,Class3,24.848,535,20815.89,,0,0,,Class4,24.853,520,28929.028,,0,0,,Class4,24.848,585,37291.622
unknown,418,773.2222,24.875,9,67,Class2,24.875,684,56626.116,Class2,24.875,839,263893.937,Class2,24.875,802,199946.829,Class3,24.875,818,130267.385,Class3,24.875,855,473603.311,Class3,24.879,650,65201.32,Class4,24.875,701,77973.915,Class4,24.875,829,127179.903,Class4,24.87,781,70076.017
Heptacosyl acetate,419,443.5,24.9,3,138,,0,0,,Class2,24.897,404,16859.328,,0,0,,Class3,24.902,483,11481.866,,0,0,,Class3,24.902,0,15500.017,,0,0,,,0,0,,,0,0,
"(4As,6R,7R,8R,8ar)-pyrano[3,2-d]-1,3-dioxin-7-ol, hexahydro-6-methoxy-8-dimethylamino-2-phenyl-",420,446.6667,24.942,12,43,Class2,24.937,447,260787.92,Class2,24.946,455,208879.281,Class2,24.946,481,326920.686,Class3,24.946,458,238342.568,Class3,24.941,457,233025.512,Class3,24.946,470,273416.67,Class4,24.928,362,214872.065,Class4,24.937,456,534267.65,Class4,24.946,467,244512.654
Ethyl 3-(methylthio)-(E)-2-propenoate,421,570.6667,24.999,3,146,,0,0,,,0,0,,,0,0,,Class3,24.995,406,9492.556,Class3,24.999,663,19597.257,Class3,25.004,643,14600.552,,0,0,,,0,0,,,0,0,
"Heptanoic acid, 3-nitrophenyl ester",422,629.5,25.043,4,113,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,25.039,651,134611.628,Class4,25.044,570,57415.488,Class4,25.044,678,122156.129,Class4,25.044,619,37020.811
5-Keto-D-fructose,423,419.5833,25.062,12,61,Class2,25.061,414,484502.414,Class2,25.061,411,465916.056,Class2,25.061,435,698591.466,Class3,25.061,418,556414.246,Class3,25.061,410,493322.325,Class3,25.061,418,760469.047,Class4,25.061,392,520263.97,Class4,25.061,469,1376632.64,Class4,25.061,421,599652.222
unknown,424,698.625,25.082,9,67,Class2,25.079,533,39350.291,Class2,25.084,824,514588.152,Class2,25.083,829,420309.658,Class3,25.084,827,351545.623,Class3,25.083,0,768360.455,Class3,25.084,691,72775.647,Class4,25.079,614,42559.742,Class4,25.084,688,93641.432,Class4,25.075,583,31701.713
"2-Propanol, 1,3-dichloro-",425,723.75,25.141,4,37,Class2,25.141,768,1622.737,Class2,25.141,598,407.211,,0,0,,Class3,25.137,722,978.69,,0,0,,Class3,25.146,807,381.311,,0,0,,,0,0,,,0,0,
Farnesene,426,776.9167,25.185,12,123,Class2,25.186,794,140671.65,Class2,25.19,764,132360.129,Class2,25.181,778,145495.101,Class3,25.186,778,125243.18,Class3,25.186,776,158010.07,Class3,25.177,750,85772.413,Class4,25.19,857,54105.145,Class4,25.186,772,119665.691,Class4,25.186,755,70671.995
"3,6-Nonadien-1-ol, (E,Z)-",427,772.75,25.275,12,93,Class2,25.274,849,2302429.17,Class2,25.279,855,9159485.17,Class2,25.274,754,2434666.78,Class3,25.275,852,3738753.51,Class3,25.279,837,12976084.1,Class3,25.275,735,3870406.5,Class4,25.275,784,2419360.71,Class4,25.275,850,3988581.84,Class4,25.275,851,1753014.41
3-Mercapto-3-methyl-1-hexanol,428,462.7,25.306,10,61,Class2,25.306,582,255280.882,Class2,25.306,446,201711.647,,0,0,,Class3,25.306,422,226491.617,,0,0,,Class3,25.306,445,400432.782,Class4,25.306,394,266815.334,Class4,25.306,548,618140.726,Class4,25.306,550,301454.619
"1,3-Dioxolane-4-methanol, 2-pentadecyl-, acetate, trans-",429,610.5,25.352,8,145,Class2,25.35,431,41109.754,Class2,25.355,604,45565.923,,0,0,,Class3,25.355,604,42032.467,Class3,25.354,730,40022.688,Class3,25.346,558,80953.689,Class4,25.355,762,40861.849,Class4,25.35,575,48839.728,Class4,25.355,620,43518.877
"Glutaric acid, 2-fluorophenyl 4-methoxybenzyl ester",430,811.375,25.404,12,121,Class2,25.408,795,138371.698,Class2,25.403,841,129761.244,Class2,25.403,767,186352.212,Class3,25.403,0,175583.362,Class3,25.403,795,136031.996,Class3,25.403,0,158638.353,Class4,25.403,0,184211.699,Class4,25.403,0,160483.074,Class4,25.403,823,183817.534
"Butanedioic acid, 2TMS derivative",431,477.375,25.478,8,147,,0,0,,Class2,25.479,519,4838.562,Class2,25.483,486,6909.356,Class3,25.479,400,4146.28,Class3,25.47,438,4841.494,,0,0,,,0,0,,Class4,25.475,358,4259.651,,0,0,
"1,3-Dioxolane, 2-(1-methylpropyl)-",432,511,25.543,11,73,Class2,25.541,560,132853.138,Class2,25.546,498,185744.453,Class2,25.541,514,227858.056,Class3,25.546,422,174866.122,Class3,25.541,531,211381.296,Class3,25.546,554,135913.13,,0,0,,Class4,25.546,446,127396.352,Class4,25.541,488,138679.547
1-Decanol,433,763.2,25.577,12,70,Class2,25.577,861,264206.17,Class2,25.577,838,178250.795,Class2,25.577,0,310378.223,Class3,25.577,837,375618.225,Class3,25.577,0,173938.61,Class3,25.572,822,208316.164,Class4,25.577,837,277165.635,Class4,25.577,905,377674.713,Class4,25.577,893,331448.118
Citronellyl butyrate,434,712.875,25.641,8,81,Class2,25.643,622,42484.572,Class2,25.639,824,170890.628,Class2,25.639,773,95110.056,Class3,25.643,749,154567.066,Class3,25.643,772,134857.323,Class3,25.639,675,33946.158,Class4,25.639,680,77044.051,Class4,25.643,608,65431.775,,0,0,
"trans,cis-2,6-Nonadien-1-ol",435,672,25.655,3,93,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,25.652,619,30826.451,Class4,25.657,629,70561.666,Class4,25.657,768,178917.513
"Oxime-, methoxy-phenyl-_",436,803.75,25.69,12,75,Class2,25.719,771,97199.736,Class2,25.67,794,312372.376,Class2,25.679,764,141728.409,Class3,25.679,767,286457.65,Class3,25.705,819,740258.445,Class3,25.71,833,119463.219,Class4,25.723,820,110959.569,Class4,25.692,791,138885.516,Class4,25.683,797,100633.608
unknown,437,683,25.685,4,120,Class2,25.674,666,198573.64,Class2,25.688,634,31495.801,,0,0,,Class3,25.723,749,20657.101,Class3,25.656,0,18120.093,,0,0,,,0,0,,,0,0,,,0,0,
"2-Propenoic acid, 2-methyl-, octyl ester",438,596.3333,25.716,3,69,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
Bis(dimethylamino)trifluorophosphorane,439,604,25.762,5,132,,0,0,,,0,0,,,0,0,,Class3,25.786,0,3798.674,Class3,25.674,761,4311.143,,0,0,,Class4,25.768,407,4473.094,Class4,25.834,556,2920.336,,0,0,
Pentanoic acid,440,665.75,25.873,8,60,Class2,25.874,527,64513.302,Class2,25.879,657,226806.155,,0,0,,,0,0,,Class3,25.927,662,119050.625,Class3,25.901,642,114138.057,,0,0,,Class4,25.941,671,198790.889,Class4,25.888,734,185923.165
"3,4-Dimethylcyclohexanol",441,559.3333,25.857,12,95,Class2,25.861,595,117672.08,Class2,25.856,0,63267.452,Class2,25.856,467,37776.551,Class3,25.857,423,43747.862,Class3,25.856,549,35893.157,Class3,25.852,593,116276.406,Class4,25.857,538,82432.126,Class4,25.857,651,129305.41,Class4,25.856,0,134245.864
"Octanal, 7-methoxy-3,7-dimethyl-",442,523.1111,26.097,9,73,Class2,26.087,500,77616.48,Class2,26.141,498,130611.373,Class2,26.083,480,83974.759,Class3,26.141,518,115490.619,,0,0,,Class3,26.083,574,55086.851,,0,0,,Class4,26.088,511,82055.782,,0,0,
"Cyclohexane, 1-methyl-4-(1-methylethenyl)-, trans-",443,651.5,26.289,3,81,,0,0,,,0,0,,Class2,26.292,614,8973.745,,0,0,,,0,0,,,0,0,,,0,0,,Class4,26.287,0,20482.271,Class4,26.287,689,20700.502
"Fumaric acid, decyl 3-methylbut-3-enyl ester",444,601.2,26.334,5,68,Class2,26.327,543,57545.791,,0,0,,,0,0,,Class3,26.341,584,125808.736,Class3,26.336,458,74396.862,,0,0,,,0,0,,,0,0,,,0,0,
unknown,445,652.8182,26.349,12,85,Class2,26.349,693,31892.635,Class2,26.35,696,20883.941,Class2,26.349,578,22122.051,Class3,26.354,666,30659.492,Class3,26.345,517,16439.85,Class3,26.345,744,24749.03,Class4,26.35,656,27185.388,Class4,26.35,625,29852.878,Class4,26.35,0,33259.412
"2,6-Octadien-1-ol, 3,7-dimethyl-, (Z)-",446,585,26.369,5,69,Class2,26.372,584,70844.929,,0,0,,,0,0,,,0,0,,,0,0,,Class3,26.367,527,45396.318,Class4,26.367,588,66012.146,Class4,26.372,555,62223.242,Class4,26.367,671,90260.098
"1,4-Benzenediol, 2,3,5-trimethyl-",447,707,26.402,9,152,Class2,26.403,733,86621.602,Class2,26.403,777,123149.633,Class2,26.403,704,39272.382,Class3,26.403,662,68464.566,Class3,26.403,668,100101.549,Class3,26.399,0,57203.725,Class4,26.403,694,129799.382,Class4,26.403,774,140262.47,Class4,26.403,644,55085.79
unknown,448,659,26.548,12,147,Class2,26.549,705,25945.665,Class2,26.549,656,28323.744,Class2,26.549,578,14214.259,Class3,26.545,666,30365.207,Class3,26.545,711,44498.736,Class3,26.55,0,26091.033,Class4,26.55,638,19793.251,Class4,26.545,706,23826.917,Class4,26.545,629,13579.197
"Phenol, 2-ethyl-",449,738.25,26.568,12,107,Class2,26.567,710,83872.127,Class2,26.567,609,57430.609,Class2,26.567,748,98386.939,Class3,26.567,817,205153.163,Class3,26.567,743,162440.559,Class3,26.567,790,185396.41,Class4,26.567,761,131361.228,Class4,26.567,770,295187.839,Class4,26.567,758,139536.414
"Dimethylmalonic acid, 2-phenethyl undecyl ester",450,716.4167,26.602,12,104,Class2,26.603,656,25553.837,Class2,26.607,684,59347.556,Class2,26.603,712,55782.304,Class3,26.603,666,54044.227,Class3,26.603,675,43740.086,Class3,26.603,720,39100.013,Class4,26.603,826,66109.223,Class4,26.598,616,40686.108,Class4,26.603,761,36735.354
unknown,451,503,26.629,12,73,Class2,26.625,561,104516.409,Class2,26.625,457,96751.131,Class2,26.629,550,103165.276,Class3,26.629,0,103677.702,Class3,26.629,440,120587.543,Class3,26.629,0,91201.439,Class4,26.629,0,92845.191,Class4,26.629,0,84804.154,Class4,26.634,451,105892.739
"2-Buten-1-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-",452,770.8889,26.668,9,177,Class2,26.669,664,32614.035,Class2,26.669,774,60436.237,Class2,26.665,788,77642.583,Class3,26.669,810,80988.143,Class3,26.665,823,88880.15,Class3,26.665,758,37983.144,Class4,26.669,770,44242.828,Class4,26.669,762,66391.096,Class4,26.669,789,57886.546
2-Chloroaniline-5-sulfonic acid,453,670,26.942,3,207,Class2,26.909,633,16303.68,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,26.958,716,38769.374,Class4,26.958,661,26387.191,,0,0,
4-Oxononanal,454,667.75,26.912,4,99,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,26.914,417,6721.845,,0,0,,,0,0,,,0,0,
"Cyclooctene, 3-(2-propenyl)-",455,528.8571,26.934,8,67,,0,0,,Class2,26.936,563,147999.163,Class2,26.927,545,46422.27,Class3,26.936,543,62290.895,Class3,26.936,578,209726.697,Class3,26.932,0,70982.034,Class4,26.936,437,41013.364,Class4,26.936,605,81019.11,Class4,26.931,431,27827.847
"Acrylonitrile, 3-bicyclo[2.2.1]hept-5-en-2-yl-2-(5-methyl-1H-benzoimidazol-2-yl)-",456,619,26.946,4,209,,0,0,,Class2,26.963,637,7319.136,Class2,26.936,549,21253.07,Class3,26.976,486,7737.209,,0,0,,,0,0,,,0,0,,,0,0,,Class4,26.909,804,1883.824
"2-Butenedioic acid, dibutyl ester",457,460.4444,27.058,9,43,Class2,27.056,555,98050.251,Class2,27.056,497,92322.375,Class2,27.056,467,78811.006,Class3,27.06,427,76503.422,Class3,27.06,460,68918.72,Class3,27.056,477,127856.502,Class4,27.065,407,96541.82,Class4,27.056,402,142467.606,Class4,27.056,452,80652.568
"Heptasiloxane, hexadecamethyl-",458,777.4167,27.114,12,147,Class2,27.113,807,86312.241,Class2,27.114,794,99167.174,Class2,27.113,737,83778.344,Class3,27.114,780,103267.821,Class3,27.113,814,142728.918,Class3,27.114,804,94662.087,Class4,27.114,807,80772.112,Class4,27.114,809,87145.745,Class4,27.114,753,65211.91
"1,1-Dimethyl-1-silacyclobutane",459,543,27.184,9,30,Class2,27.185,582,26012.222,Class2,27.185,592,53285.648,Class2,27.185,0,45346.311,Class3,27.185,569,52021.7,Class3,27.18,515,24043.748,Class3,27.185,464,23075.014,Class4,27.18,604,72017.843,Class4,27.185,478,24428.995,Class4,27.185,540,25309.109
"(1,2,3-Trimethyl-cyclopent-2-enyl)-methanol",460,481.75,27.23,4,67,,0,0,,Class2,27.238,530,61630.219,,0,0,,,0,0,,Class3,27.229,492,74921.092,Class3,27.229,479,24281.856,,0,0,,Class4,27.225,426,20764.656,,0,0,
"1H-Imidazole, 1-(1-naphthalenylmethyl)-",461,623,27.272,3,142,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,27.273,603,14095.36
"Octanoic acid, 2-methyl-, methyl ester",462,561.3333,27.291,3,88,,0,0,,Class2,27.291,574,35266.427,,0,0,,,0,0,,Class3,27.291,533,37009.433,Class3,27.291,577,24830.296,,0,0,,,0,0,,,0,0,
"Phenol, 2-chloro-",463,769.5,27.31,3,128,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
Ionone,464,765.7273,27.379,12,121,Class2,27.38,748,1186785.63,Class2,27.38,753,1029527.87,Class2,27.376,0,1029593.71,Class3,27.38,735,849922.958,Class3,27.38,786,669999.09,Class3,27.376,751,1271095.7,Class4,27.38,922,1040406.15,Class4,27.38,746,1727545.06,Class4,27.38,734,1459248
"5,9-Undecadien-2-one, 6,10-dimethyl-, (E)-",465,796.75,27.478,12,151,Class2,27.478,797,135650.502,Class2,27.482,789,75556.512,Class2,27.478,803,100368.289,Class3,27.478,832,148694.084,Class3,27.478,806,98529.512,Class3,27.473,801,120757.133,Class4,27.478,809,91113.663,Class4,27.478,800,120480.617,Class4,27.473,825,126277.156
"1H-Indene, octahydro-2,3a,4-trimethyl-2-(1-methylethyl)-, (23a47a-(+)-",466,488.8571,27.581,8,109,Class2,27.58,414,20533.243,,0,0,,,0,0,,Class3,27.58,368,23973.366,,0,0,,Class3,27.585,0,25249.037,,0,0,,Class4,27.576,466,31291.201,Class4,27.58,495,36016.71
unknown,467,590.7778,27.611,9,93,Class2,27.607,527,19088.549,Class2,27.611,643,70038.52,Class2,27.611,547,24305.423,Class3,27.607,715,36863.228,Class3,27.611,783,102001.813,Class3,27.611,693,35277.388,Class4,27.616,530,24800.148,Class4,27.611,488,38845.088,Class4,27.616,391,28156.329
"1-Heptene, 1,3-diphenyl-1-(trimethylsilyloxy)-",468,484.6667,27.658,6,281,Class2,27.664,397,9692.694,,0,0,,Class2,27.655,475,16645.382,,0,0,,,0,0,,,0,0,,,0,0,,Class4,27.651,431,6754.608,,0,0,
"2-Propenenitrile, 3-phenyl-, (E)-",469,703.875,27.682,8,129,Class2,27.686,559,18636.808,Class2,27.687,822,50384.478,Class2,27.682,918,141906.851,Class3,27.682,692,57336.155,Class3,27.682,784,54230.423,Class3,27.673,711,31996.599,Class4,27.678,531,18725.605,Class4,27.687,614,21699.734,,0,0,
"Propanoic acid, 2-methyl-, 3-hydroxy-2,2,4-trimethylpentyl ester",470,740.9,27.769,12,71,Class2,27.766,0,99431.08,Class2,27.771,763,80842.638,Class2,27.766,689,90062.556,Class3,27.78,608,93668.084,Class3,27.766,0,78234.536,Class3,27.767,759,97951.224,Class4,27.771,743,90949.446,Class4,27.767,643,96226.283,Class4,27.771,730,126140.887
Tetrahydrosolasodine,471,548.3333,27.798,5,98,Class2,27.802,426,20134.656,Class2,27.802,647,60533.681,Class2,27.798,0,57856.562,,0,0,,Class3,27.798,0,46305.101,,0,0,,,0,0,,Class4,27.789,572,30182.62,,0,0,
"1-Oxaspiro[4.5]deca-3,6-diene, 2,6,10,10-tetramethyl-",472,603,27.824,6,136,Class2,27.82,551,16392.926,,0,0,,,0,0,,,0,0,,,0,0,,Class3,27.824,585,17339.335,,0,0,,Class4,27.82,580,19382.413,,0,0,
"3-Cyclohexene-1-methanol, 4-dimethyl-",473,472.6667,27.828,6,93,,0,0,,Class2,27.833,467,38722.305,Class2,27.824,496,23583.142,Class3,27.829,437,31705.166,Class3,27.824,516,59048.778,,0,0,,,0,0,,Class4,27.824,466,31314.622,Class4,27.833,454,16034.363
Benzyl alcohol,474,948.75,27.891,12,108,Class2,27.891,959,8626300.25,Class2,27.891,922,6416008,Class2,27.891,955,7241005.98,Class3,27.891,956,6967916.08,Class3,27.891,960,9318345.36,Class3,27.891,956,11071036,Class4,27.891,955,6593814.49,Class4,27.891,956,13755507,Class4,27.891,956,8304140.41
Hexanoic acid,475,770.3333,27.984,3,61,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
3-{4-[2-(Cyclopropylmethoxy)ethyl]phenoxy}-N-(1-methylethyl)-2-[(trimethylsilyl)oxy]propan-1-amine,476,519,27.961,8,72,Class2,27.966,505,97366.437,Class2,27.966,518,90742.496,Class2,27.962,537,78513.609,Class3,27.962,507,106180.451,Class3,27.953,440,50882.638,Class3,27.962,543,93352.024,,0,0,,Class4,27.962,558,95435.936,Class4,27.958,544,125246.085
"2,2,4-Trimethyl-1,3-pentanediol diisobutyrate",477,715.5,27.973,12,71,Class2,27.975,872,340954.015,Class2,27.971,775,259343.696,Class2,27.975,699,198687.544,Class3,27.971,570,204637.455,Class3,27.975,608,128950.228,Class3,27.975,573,171193.647,Class4,27.971,603,135865.353,Class4,27.971,618,204473.775,Class4,27.971,824,458497.541
"Naphthalene, 2-methyl-",478,725.25,28.024,4,142,Class2,28.029,720,9018.931,Class2,28.029,755,8757.808,,0,0,,,0,0,,,0,0,,,0,0,,Class4,28.02,682,8776.8,,0,0,,Class4,28.02,744,11389.507
unknown,479,643.9091,28.08,12,71,Class2,28.077,655,210967.252,Class2,28.082,640,181501.23,Class2,28.077,701,186971.585,Class3,28.078,649,174520.444,Class3,28.077,646,150872.146,Class3,28.078,649,189820.119,Class4,28.082,668,173654.021,Class4,28.082,658,134041.311,Class4,28.082,612,261239.238
trans-2-(2-Pentenyl)furan,480,552.3333,28.18,6,136,Class2,28.166,496,10469.305,,0,0,,,0,0,,,0,0,,Class3,28.184,431,6855.838,Class3,28.18,432,13374.394,,0,0,,,0,0,,,0,0,
Epi-Inositol,481,608,28.182,11,60,Class2,28.131,662,246990.847,Class2,28.126,643,1144448.17,Class2,28.224,670,168025.843,Class3,28.229,578,303804.222,Class3,28.197,566,138740.748,Class3,28.135,610,462284.6,Class4,28.175,610,402864.989,Class4,28.198,572,765702.704,Class4,28.193,554,963275.663
unknown,482,545.375,28.262,8,281,Class2,28.268,611,2927.326,Class2,28.26,551,10759.83,Class2,28.251,515,78673.988,Class3,28.331,603,4841.327,,0,0,,,0,0,,Class4,28.242,377,17221.104,,0,0,,Class4,28.273,609,12419.211
"1,2-Benzendiol, O-(2-chloropropionyl)-O'-(4-fluorobenzoyl)-",483,736.2222,28.344,9,123,Class2,28.348,825,33745.417,Class2,28.34,701,63506.642,Class2,28.344,764,85387.729,Class3,28.344,815,111065.326,Class3,28.344,733,90542.875,,0,0,,Class4,28.344,697,37354.865,Class4,28.344,795,56208.591,Class4,28.34,697,45528.637
"(1R,3E,7E,11R)-1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene",484,563.25,28.418,5,109,Class2,28.419,658,62264.54,Class2,28.42,533,34419.002,,0,0,,Class3,28.415,552,51075.9,Class3,28.415,510,28304.937,,0,0,,,0,0,,,0,0,,Class4,28.42,0,49284.177
"3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)-",485,749.375,28.429,9,95,Class2,28.428,642,117487.018,Class2,28.428,708,127891.518,Class2,28.428,851,264574.372,Class3,28.433,860,260385.546,Class3,28.433,817,181563.46,Class3,28.429,0,107153.057,Class4,28.433,799,87691.136,Class4,28.42,634,90389.346,Class4,28.428,684,111972.246
unknown,486,529.5,28.497,7,281,Class2,28.49,0,4219.42,Class2,28.486,593,6047.669,,0,0,,Class3,28.446,521,4831.35,,0,0,,,0,0,,,0,0,,Class4,28.451,520,5078.448,Class4,28.557,495,5572.346
Phenylethyl Alcohol,487,954.5833,28.628,12,91,Class2,28.628,950,1995270.85,Class2,28.628,954,3479264.83,Class2,28.628,954,6150129.53,Class3,28.628,956,5344337.99,Class3,28.628,955,3171616.11,Class3,28.628,953,4232476.1,Class4,28.628,958,5074669.51,Class4,28.628,952,4856375.59,Class4,28.628,952,4208113.14
Butylated Hydroxytoluene,488,642.5455,28.662,12,85,Class2,28.659,557,54145.78,Class2,28.659,731,46368.353,Class2,28.659,458,40910.179,Class3,28.668,544,41060.556,Class3,28.659,783,40610.665,Class3,28.659,0,50522.187,Class4,28.673,708,41644.728,Class4,28.664,575,43179.081,Class4,28.659,612,50585.128
"Phosphoric acid, dibutyl 1,1-dimethyl-2,2,3,3-tetrafluoropropyl ester",489,700.4,28.831,12,99,Class2,28.833,663,195599.605,Class2,28.828,691,154697.341,Class2,28.833,0,217601.054,Class3,28.833,671,180017.002,Class3,28.833,0,159154.702,Class3,28.833,762,208182.139,Class4,28.828,724,190084.075,Class4,28.828,707,200417.915,Class4,28.833,705,192408.777
"Hexanal, 4,4-dimethyl-",490,536.5833,28.906,12,81,Class2,28.904,524,33347.728,Class2,28.913,550,36478.274,Class2,28.908,594,106398.755,Class3,28.908,584,100070.809,Class3,28.917,550,47741.168,Class3,28.904,502,22257.347,Class4,28.908,532,32315.979,Class4,28.904,538,21240.149,Class4,28.904,508,15867.887
"Glutaric acid, di(1-phenylpropyl) ester",491,507.6667,28.956,3,135,,0,0,,,0,0,,,0,0,,,0,0,,Class3,28.957,571,14826.178,Class3,28.957,490,8264.238,Class4,28.953,462,6813.558,,0,0,,,0,0,
unknown,492,655.375,28.974,9,123,Class2,28.975,706,20029.943,Class2,28.975,447,10560.826,Class2,28.975,627,18927.357,,0,0,,,0,0,,Class3,28.97,545,16277.876,Class4,28.979,467,11233.984,Class4,28.97,0,17436.465,,0,0,
"1,2,3,4-Tetradecanetetrol, [2R-(2R*,3S*,4S*)]-",493,392.5,28.984,6,61,,0,0,,Class2,28.979,331,205918.826,,0,0,,Class3,28.984,403,238340.225,Class3,28.988,472,256216.936,Class3,28.984,342,59619.906,,0,0,,Class4,28.984,425,153669.873,Class4,28.988,382,133344.782
"2-Benzofurancarboxylic acid, 2,4,5,6,7,7a-hexahydro-4,4,7a-trimethyl-, methyl ester, cis-",494,649.4286,29.008,7,165,Class2,29.01,741,94244.674,,0,0,,,0,0,,,0,0,,,0,0,,Class3,29.006,730,83658.017,Class4,29.01,594,60248.459,Class4,29.01,545,59793.063,Class4,29.006,747,79910.556
"Silane, ethenyldiethylmethyl-",495,515.75,29.035,9,71,Class2,29.032,525,127311.979,Class2,29.033,516,80784.714,,0,0,,Class3,29.037,457,75276.43,Class3,29.032,549,63321.323,Class3,29.037,478,57873.917,Class4,29.037,543,74788.959,Class4,29.033,583,67319.515,Class4,29.033,0,61967.494
"Dithiocarbonic acid, S-(2,3-diphenyl-1-p-tolyl-cycloprop-2-enyl)ester-O-ethyl ester",496,547.3333,29.08,3,281,,0,0,,,0,0,,,0,0,,Class3,29.099,541,3768.969,,0,0,,Class3,29.09,533,2132.829,,0,0,,Class4,29.05,568,2628.381,,0,0,
"3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-",497,920.75,29.213,12,177,Class2,29.215,919,4166959.34,Class2,29.215,927,3967990.8,Class2,29.21,926,3932120.4,Class3,29.215,922,4045561.33,Class3,29.215,921,3361820.46,Class3,29.21,924,4650346.94,Class4,29.215,917,3289407.99,Class4,29.215,921,7452388.03,Class4,29.21,924,5036036.28
"1,2-Benzenediol, o-(4-methoxybezoyl)-o'-(5-chlorovaleryl)-",498,605.3333,29.467,7,135,,0,0,,,0,0,,Class2,29.463,620,23756.205,Class3,29.464,0,29912.297,,0,0,,Class3,29.468,541,30189.768,,0,0,,,0,0,,Class4,29.468,592,43741.63
2-Methoxy-5-methylphenol,499,867.5,29.478,6,138,Class2,29.481,906,550997.713,Class2,29.481,903,377367.77,,0,0,,,0,0,,,0,0,,Class3,29.477,869,242856.905,Class4,29.477,794,369223.028,Class4,29.477,831,392935.349,Class4,29.477,902,241858.953
"2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-",500,816.4,29.518,10,161,Class2,29.517,843,85923.653,Class2,29.517,854,65442.548,Class2,29.517,858,51821.145,Class3,29.521,857,67228.24,Class3,29.517,861,56901.069,Class3,29.517,820,67212.057,Class4,29.521,756,51922.662,Class4,29.517,795,58416.58,Class4,29.517,868,67321.845
Neophytadiene,501,670.2,29.584,12,123,Class2,29.592,588,11762.299,Class2,29.579,877,92213.643,Class2,29.583,686,115214.958,Class3,29.579,735,143265.441,Class3,29.583,651,100854.853,Class3,29.579,586,46125.967,Class4,29.583,0,39532.062,Class4,29.583,0,48032.028,Class4,29.597,527,10263.35
"5,9-Undecadien-2-ol, 6,10-dimethyl-",502,635.3333,29.608,9,153,Class2,29.61,609,21750.444,Class2,29.606,635,22924.202,Class2,29.61,675,20014.751,Class3,29.606,615,35735.764,Class3,29.61,727,29049.034,Class3,29.606,464,18966.839,Class4,29.606,656,15020.572,Class4,29.61,685,22651.538,Class4,29.61,652,22247.415
unknown,503,533.75,29.637,4,165,,0,0,,Class2,29.637,473,36513.901,Class2,29.641,550,29061.286,,0,0,,Class3,29.637,537,31638.288,,0,0,,Class4,29.632,575,31085.082,,0,0,,,0,0,
"1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(14a4b710a]-",504,489.6,29.657,6,121,Class2,29.659,523,23433.3,,0,0,,,0,0,,,0,0,,,0,0,,Class3,29.659,485,14180.405,Class4,29.65,427,17327.992,Class4,29.655,0,34001.571,Class4,29.659,519,15557.679
"2-(2',4',4',6',6',8',8'-Heptamethyltetrasiloxan-2'-yloxy)-2,4,4,6,6,8,8,10,10-nonamethylcyclopentasiloxane",505,541.75,29.752,4,147,,0,0,,,0,0,,Class2,29.752,537,34262.09,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,29.748,519,20222.367
unknown,506,475.25,29.753,4,147,,0,0,,,0,0,,,0,0,,Class3,29.752,416,28696.092,,0,0,,Class3,29.752,505,23667.131,Class4,29.748,542,13487.11,,0,0,,,0,0,
"N-(Trifluoroacetyl)-N,O,O',O''-tetrakis(trimethylsilyl)norepinephrine",507,474.7778,29.774,9,45,Class2,29.774,520,255612.618,Class2,29.779,407,685146.603,Class2,29.779,333,412254.859,Class3,29.774,486,878422.894,Class3,29.779,376,916886.782,Class3,29.774,535,253324.445,Class4,29.774,499,259127.147,Class4,29.77,452,457596.876,Class4,29.765,665,408133.295
"5-Chlorovaleric acid, 3,5-dimethylphenyl ester",508,577.3636,29.827,11,122,Class2,29.823,415,17009.862,Class2,29.823,418,14087.393,Class2,29.823,476,24791.306,Class3,29.828,660,49898.369,Class3,29.828,585,30842.685,,0,0,,Class4,29.832,551,25874.028,Class4,29.828,679,68100.56,Class4,29.828,641,29203.782
1-Tetradecanol,509,705.7273,29.87,12,83,Class2,29.876,681,27892.917,Class2,29.877,0,24788.151,Class2,29.872,681,27488.756,Class3,29.872,766,27035.487,Class3,29.872,695,19765.017,Class3,29.868,701,20848.961,Class4,29.868,746,27018.545,Class4,29.863,627,33501.13,Class4,29.868,774,38868.837
"1H-Indene-4-carboxaldehyde, 2,3-dihydro-",510,624.7778,29.993,10,146,Class2,29.996,693,33700.186,Class2,29.996,0,29385.662,Class2,29.996,595,24272.149,Class3,29.992,636,20887.423,Class3,30.001,580,19912.285,,0,0,,,0,0,,Class4,29.992,446,9733.138,Class4,29.992,538,17290.505
unknown,511,504.5556,30.006,10,147,Class2,30.005,535,17970.172,,0,0,,,0,0,,Class3,30.001,537,17920.353,Class3,30.005,644,30782.677,Class3,30.01,412,14929.777,Class4,30.01,358,11881.912,Class4,30.005,0,16258.501,Class4,30.001,406,9940.361
unknown,512,656.75,30.139,9,82,Class2,30.138,0,9613.144,Class2,30.139,643,5379.75,Class2,30.143,649,9927.887,Class3,30.134,671,8936.499,,0,0,,,0,0,,,0,0,,Class4,30.134,665,10581.543,Class4,30.139,678,12357.755
2-Ethyl-hexoic acid,513,661.2,30.307,6,88,Class2,30.312,622,94314.604,,0,0,,,0,0,,,0,0,,Class3,30.338,689,100642.632,Class3,30.307,0,246980.331,Class4,30.339,614,174793.734,,0,0,,Class4,30.316,681,246124.026
"Androstane-11,17-dione, 3-[(trimethylsilyl)oxy]-, 17-[O-(phenylmethyl)oxime], (35-",514,516.0833,30.246,12,281,Class2,30.245,515,32201.778,Class2,30.245,582,36675.518,Class2,30.245,602,35385.595,Class3,30.245,562,42956.366,Class3,30.245,604,59083.442,Class3,30.245,425,35746.581,Class4,30.25,510,32074.852,Class4,30.241,434,35084.304,Class4,30.245,484,29178.293
"3-Buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-",515,836.1818,30.259,12,123,Class2,30.258,0,2392168.45,Class2,30.259,850,1821550.92,Class2,30.258,855,1578677.28,Class3,30.259,854,1829120.01,Class3,30.258,872,1388249.68,Class3,30.259,855,2225019.62,Class4,30.259,849,1730881.24,Class4,30.259,782,3207109.28,Class4,30.259,790,2077510.38
Amiodarone,516,650.6364,30.351,12,86,Class2,30.352,679,655096.881,Class2,30.352,632,380845.272,Class2,30.352,670,645279.991,Class3,30.352,675,644718.784,Class3,30.352,685,348092.894,Class3,30.352,677,637999.483,Class4,30.347,0,326805.468,Class4,30.352,626,466037.238,Class4,30.352,690,437383.698
unknown,517,567,30.463,5,60,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,30.49,608,89425.714,Class4,30.512,527,96724.709,,0,0,,Class4,30.476,581,166966.241
"Phosphonic acid, (p-hydroxyphenyl)-",518,720.75,30.46,12,94,Class2,30.463,645,141895.647,Class2,30.463,694,130167.721,Class2,30.463,684,115818.484,Class3,30.459,661,111486.192,Class3,30.463,745,115500.165,Class3,30.459,763,155777.398,Class4,30.459,761,137919.743,Class4,30.459,672,135517.016,Class4,30.463,641,169137.571
"2-Bornanol, 3-(methylamino)-, endo,endo-",519,460.0909,30.573,11,98,Class2,30.569,559,42269.779,Class2,30.574,503,23606.078,Class2,30.574,405,16077.201,Class3,30.574,461,19661.12,Class3,30.574,467,15494.235,Class3,30.574,458,19625.778,Class4,30.57,478,21582.476,Class4,30.565,444,15390.244,Class4,30.574,409,19187.403
Bicyclo[5.3.0]decane (cis),520,648.3333,30.628,9,67,Class2,30.627,661,33808.911,Class2,30.627,615,52486.23,Class2,30.627,697,59183.568,Class3,30.623,764,54554.931,Class3,30.632,628,64551.682,Class3,30.627,524,39900.335,Class4,30.627,700,43871.114,Class4,30.627,694,75246.192,Class4,30.632,552,38712.601
Methyleugenol,521,903.1111,30.657,9,163,Class2,30.658,931,73409.508,Class2,30.658,867,173765.777,Class2,30.658,847,131260.525,Class3,30.654,895,59602.9,Class3,30.658,923,303194.542,Class3,30.654,873,144673.049,Class4,30.658,927,183666.667,Class4,30.658,952,383738.048,Class4,30.658,913,171191.978
1-Methyl-2-tert-butylpyrrole,522,458.1667,30.796,12,122,Class2,30.796,442,19567.643,Class2,30.792,470,16549.271,Class2,30.805,486,16621.996,Class3,30.796,444,18346.81,Class3,30.791,441,17234.584,Class3,30.796,470,18962.225,Class4,30.796,390,16038.911,Class4,30.796,506,14555.291,Class4,30.796,383,14693.855
"Acetamide, N-hexyl-",523,617.8889,30.86,9,30,Class2,30.858,563,43162.42,Class2,30.858,755,72352.56,Class2,30.867,728,32417.649,Class3,30.863,720,52387.93,Class3,30.858,634,32943.637,Class3,30.858,534,40604.388,Class4,30.858,596,52666.359,Class4,30.858,553,52426.333,Class4,30.863,478,31427.307
"2(3H)-Furanone, dihydro-3-hydroxy-4,4-dimethyl-, (-",524,710.4167,30.916,12,71,Class2,30.916,689,901650.441,Class2,30.916,681,918505.613,Class2,30.916,707,1641359.69,Class3,30.916,701,2163253.97,Class3,30.916,718,808180.714,Class3,30.916,731,897888.658,Class4,30.916,867,767687.686,Class4,30.912,709,1157752.26,Class4,30.912,707,1032256.88
"2(3H)-Furanone, dihydro-5-pentyl-",525,734,30.924,9,85,,0,0,,Class2,30.925,683,201462.915,Class2,30.925,751,197686.788,Class3,30.925,763,231458.1,Class3,30.925,819,243250.864,Class3,30.925,709,154016.767,Class4,30.925,799,192439.719,Class4,30.92,0,293468.229,Class4,30.925,751,205012.598
"Butanoic acid, 3-methyl-, 3,7-dimethyl-6-octenyl ester",526,696.5714,31.014,7,138,Class2,31.009,627,8113.283,Class2,31.014,730,7868.114,,0,0,,Class3,31.023,706,7950.336,,0,0,,Class3,31.014,741,13574.889,Class4,31.009,645,7303.619,Class4,31.014,637,23052.468,Class4,31.014,790,15431.865
"2H-Pyran, 5,6-dihydro-5-acetoxy-2-[4-(4-pentylcyclohexyl)cyclohexyloxy]-",527,488,31.052,4,81,Class2,31.054,477,37898.086,,0,0,,,0,0,,,0,0,,,0,0,,Class3,31.049,556,102475.238,Class4,31.049,480,53680.62,Class4,31.054,439,83959.824,,0,0,
Pipradrol,528,421.2,31.094,5,153,,0,0,,,0,0,,,0,0,,Class3,31.094,363,8883.161,,0,0,,,0,0,,,0,0,,Class4,31.089,494,24098.653,Class4,31.094,449,14724.728
unknown,529,571.8571,31.174,8,147,Class2,31.173,0,9306.738,Class2,31.178,445,13099.464,Class2,31.169,714,15605.279,Class3,31.169,613,13660.975,,0,0,,,0,0,,Class4,31.169,603,9763.773,Class4,31.178,577,8775.804,Class4,31.169,522,10530.74
"Acetonitrile, 2-(4-methoxyphenyl)-2-(3-phenyl-4,5-dihydropyrazol-1-yl)-",530,587.375,31.192,8,146,Class2,31.196,633,13717.635,,0,0,,Class2,31.187,520,7589.087,Class3,31.187,466,7728.028,,0,0,,,0,0,,Class4,31.2,594,6736.529,,0,0,,Class4,31.187,578,11540.822
3-Phenylpropanol,531,814,31.316,10,117,Class2,31.32,835,35782.588,Class2,31.311,784,19529.41,Class2,31.316,864,43031.948,Class3,31.311,812,23132.36,Class3,31.325,795,26092.179,Class3,31.32,843,37619.218,Class4,31.316,777,24974.959,Class4,31.316,885,54039.029,Class4,31.311,853,36198.015
"Diboroxide, trimethylphenyl-",532,449.25,31.412,8,113,Class2,31.418,534,54108.157,Class2,31.413,519,60216.018,Class2,31.413,414,17973.718,Class3,31.418,457,55342.806,Class3,31.409,509,28002.453,Class3,31.409,374,12382.126,Class4,31.414,380,7985.999,Class4,31.405,407,7482.756,,0,0,
"3,4-Dimethoxybenzoic anhydride",533,522.6667,31.463,6,165,Class2,31.467,535,21270.866,,0,0,,,0,0,,,0,0,,Class3,31.462,452,7697.729,Class3,31.458,463,19155.899,Class4,31.467,458,14176.045,Class4,31.458,578,11498.266,Class4,31.467,650,17841.506
"Naphthalene, 1,1'-(1,2-ethanediyl)bis-",534,644.8333,31.502,6,141,,0,0,,Class2,31.507,527,11742.969,Class2,31.507,593,6939.528,Class3,31.489,756,15014.253,,0,0,,Class3,31.502,549,10262.565,,0,0,,Class4,31.502,654,12877.96,Class4,31.507,790,16933.938
"13-Octadecenal, (Z)-",535,675.6667,31.581,3,82,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,31.573,791,10948.553,,0,0,,Class4,31.582,565,17722.519,Class4,31.587,671,15629.996
"5,6-Dichloro-2-[[4-[[2-diethylamino-1-methylethyl]amino]-6-methyl-2-pyrimidinyl]amino]benzimidazole",536,616.5,31.696,4,86,,0,0,,Class2,31.693,605,35976.513,Class2,31.698,623,22342.302,Class3,31.693,624,30294.056,Class3,31.698,614,20443.468,,0,0,,,0,0,,,0,0,,,0,0,
"5-Cyano-1,2,3-thiadiazole",537,450,31.751,8,83,,0,0,,Class2,31.751,447,20978.625,Class2,31.747,567,32298,Class3,31.751,518,37828.515,Class3,31.751,402,13134.307,Class3,31.751,418,20441.751,,0,0,,Class4,31.751,434,24236.473,Class4,31.751,403,19038.479
unknown,538,519,31.838,3,73,Class2,31.822,373,132201.9,,0,0,,Class2,31.822,584,207446.418,,0,0,,Class3,31.871,600,203718.619,,0,0,,,0,0,,,0,0,,,0,0,
"2H-Octahydropyrido[1,2-a]pyrazin-1-one",539,441.3333,31.822,3,84,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"Phenol, 4-(2-methylpropyl)-",540,602,31.953,5,107,Class2,31.955,623,16839.636,Class2,31.955,603,15972.968,,0,0,,,0,0,,,0,0,,Class3,31.955,0,21450.003,,0,0,,Class4,31.951,565,14292.813,,0,0,
Vitamin C,541,432.5,32.229,3,116,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class3,32.266,398,7600.807,,0,0,,,0,0,,,0,0,
"Sarcosylsarcosine, N-methoxycarbonyl-, dodecyl ester",542,510.3333,32.26,3,102,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
unknown,543,664.9167,32.374,12,151,Class2,32.377,695,29109.193,Class2,32.373,649,32397.442,Class2,32.373,665,28278.882,Class3,32.373,700,30263.596,Class3,32.373,712,27181.085,Class3,32.382,628,29324.069,Class4,32.369,663,31778.666,Class4,32.373,642,31185.439,Class4,32.373,696,18350.787
"2,5-cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-hydroxy-4-methyl-",544,636.75,32.393,12,165,Class2,32.391,602,31515.115,Class2,32.395,650,30944.821,Class2,32.395,655,32345.959,Class3,32.391,605,34240,Class3,32.395,657,25541.737,Class3,32.391,637,32695.614,Class4,32.395,644,28548.365,Class4,32.391,624,29121.689,Class4,32.391,655,39254.691
"2,4,7,9-Tetramethyl-5-decyn-4,7-diol",545,709.8333,32.484,12,151,Class2,32.484,704,34644.599,Class2,32.488,753,42372.014,Class2,32.484,685,35197.147,Class3,32.484,704,39065.971,Class3,32.479,737,30567.594,Class3,32.48,687,37957.293,Class4,32.484,726,40824.745,Class4,32.484,760,42048.282,Class4,32.488,720,31461.244
Octanoic acid,546,674.6667,32.582,7,60,,0,0,,,0,0,,Class2,32.613,455,38030.654,,0,0,,,0,0,,Class3,32.6,0,201634.613,Class4,32.622,567,111164.622,Class4,32.622,696,98293.341,Class4,32.573,751,183029.298
"3-Methyl-2-(3,7,11-trimethyldodecyl) furan",547,707.4286,32.559,7,109,,0,0,,Class2,32.559,808,45763.055,Class2,32.559,771,53004.578,Class3,32.564,674,35292.028,Class3,32.559,800,61729.593,Class3,32.555,565,19048.277,Class4,32.56,627,15947.754,Class4,32.56,707,8044.191,,0,0,
"1,1,6-trimethyl-3-methylene-2-(3,6,9,13-tetramethyl-6-ethenye-10,14-dimethylene-pentadec-4-enyl)cyclohexane",548,572.6667,32.646,12,149,Class2,32.648,678,182909.046,Class2,32.644,585,80867.506,Class2,32.648,549,46192.922,Class3,32.644,485,74653.261,Class3,32.644,606,63424.824,Class3,32.648,594,147857.551,Class4,32.644,634,102077.825,Class4,32.644,625,106082.343,Class4,32.648,603,110495.806
"(3R,3aS,6S,7R)-3,6,8,8-Tetramethyloctahydro-1H-3a,7-methanoazulen-6-ol",549,672.7273,32.733,11,95,Class2,32.728,703,25344.341,Class2,32.733,577,14987.424,Class2,32.728,611,16279.757,Class3,32.733,615,17977.263,,0,0,,Class3,32.742,676,20417.269,Class4,32.742,591,12562.83,Class4,32.733,517,17763.04,Class4,32.733,780,27606.588
5H-Tetrazol-5-amine,550,649.5455,32.789,11,85,Class2,32.79,649,184363.047,Class2,32.786,678,108766.94,Class2,32.786,692,127008.949,Class3,32.791,660,91094.094,Class3,32.786,695,69811.396,Class3,32.791,635,229399.61,Class4,32.786,635,256883.759,Class4,32.791,677,207079.973,Class4,32.795,650,221350.354
"2-Pentadecanone, 6,10,14-trimethyl-",551,596,32.888,7,123,,0,0,,Class2,32.893,545,9381.691,Class2,32.884,715,6931.212,Class3,32.888,574,11221.11,Class3,32.884,726,9855.724,,0,0,,Class4,32.888,607,6966.769,Class4,32.888,504,7218.964,Class4,32.893,501,9493.838
Norpipanone,552,636.8889,33.017,12,98,Class2,33.021,601,49375.116,Class2,33.021,0,41562.091,Class2,33.017,576,53901.488,Class3,33.017,643,76870.553,Class3,33.012,0,30801.88,Class3,33.008,608,43877.528,Class4,33.017,676,48331.345,Class4,33.017,623,53671.306,Class4,33.017,618,46697.408
Tributyl phosphate,553,650.7273,33.055,12,99,Class2,33.052,0,31411.404,Class2,33.057,741,27312.09,Class2,33.057,564,34678.294,Class3,33.053,586,24001.374,Class3,33.048,716,26262.857,Class3,33.057,559,26896.395,Class4,33.057,549,26040.767,Class4,33.057,623,28416.255,Class4,33.053,624,24494.466
"1,1,1,3,5,7,7,7-Octamethyl-3,5-bis(trimethylsiloxy)tetrasiloxane",554,584.7273,33.174,11,147,Class2,33.177,616,16874.96,Class2,33.177,624,16858.019,Class2,33.177,627,16089.815,Class3,33.173,570,18629.073,Class3,33.172,680,22888.117,Class3,33.177,531,15211.388,Class4,33.173,564,13601.529,Class4,33.168,541,16411.868,Class4,33.172,538,15117.447
"Thiophane, propyl-",555,671.25,33.224,5,87,Class2,33.226,799,13851.368,,0,0,,,0,0,,,0,0,,,0,0,,Class3,33.244,676,26397.71,Class4,33.253,531,23206.245,,0,0,,,0,0,
"1,3-Benzenediol, 5-pentyl-",556,595.75,33.288,12,124,Class2,33.288,595,63821.313,Class2,33.292,500,37195.399,Class2,33.288,430,43246.603,Class3,33.288,652,90744.646,Class3,33.288,476,16564.467,Class3,33.288,641,69881.348,Class4,33.288,612,59354.54,Class4,33.288,639,101393.724,Class4,33.284,607,135040.004
"quinoline, 7-chloro-",557,813.3636,33.324,12,163,Class2,33.323,0,272857.357,Class2,33.324,845,391977.363,Class2,33.323,884,984581.978,Class3,33.324,885,506294.284,Class3,33.323,878,368308.776,Class3,33.319,857,273008.7,Class4,33.324,879,273768.1,Class4,33.324,840,268760.714,Class4,33.324,771,113234.362
Eugenol,558,918.6364,33.55,12,149,Class2,33.55,965,1133192.56,Class2,33.55,970,1978013.75,Class2,33.55,856,34268.181,Class3,33.546,908,32801.546,Class3,33.55,915,83355.325,Class3,33.55,968,1477833.65,Class4,33.55,972,1610994.42,Class4,33.55,970,2265138.7,Class4,33.546,970,1384884.81
"Succinic acid, 2-fluorophenyl phenethyl ester",559,569.4286,33.748,7,105,Class2,33.75,542,19242.796,,0,0,,Class2,33.745,603,13107.901,Class3,33.75,639,14837.972,,0,0,,,0,0,,Class4,33.746,557,14723.702,,0,0,,,0,0,
"Benzene, 1,2-dimethoxy-4-(1-propenyl)-",560,758,33.842,5,163,,0,0,,Class2,33.848,722,5307.002,,0,0,,,0,0,,Class3,33.839,770,7628.162,,0,0,,Class4,33.843,788,10381.772,Class4,33.843,709,9766.394,Class4,33.839,801,11827.307
Caprolactam,561,708,33.929,9,113,Class2,33.932,792,34611.753,Class2,33.928,692,18149.714,,0,0,,Class3,33.928,669,18947.402,Class3,33.923,753,26821.062,Class3,33.928,581,9284.492,Class4,33.928,845,31606.12,Class4,33.932,584,9603.886,Class4,33.928,738,31825.482
"5-Methylsalicylic acid, 2TMS derivative",562,679.7143,34.049,8,281,Class2,34.039,705,170846.42,,0,0,,Class2,34.052,678,531531.468,Class3,34.057,686,203422.244,,0,0,,Class3,34.057,0,126451.031,Class4,34.052,756,52377.625,Class4,34.052,682,69746.22,,0,0,
Methyl 8-methyl-nonanoate,563,532.6667,34.189,4,74,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,Class4,34.247,0,42975.627
"1,2-Ethanediamine, N,N'-dimethyl-N,N'-bis(1-methylethyl)-",564,539.6667,34.27,3,44,,0,0,,,0,0,,,0,0,,Class3,34.274,575,26874.262,,0,0,,Class3,34.27,504,29726.585,Class4,34.265,540,64449.499,,0,0,,,0,0,
"1H-Indene, 2,3-dihydro-1,1,3-trimethyl-3-phenyl-",565,605.75,34.377,4,143,,0,0,,,0,0,,,0,0,,,0,0,,Class3,34.367,668,5294.847,,0,0,,Class4,34.385,512,6113.926,,0,0,,Class4,34.372,666,4255.494
"Phenol, 2-methyl-5-(1-methylethyl)-",566,858,34.431,11,135,Class2,34.434,866,50039.229,Class2,34.43,891,159523.566,Class2,34.429,794,42760.26,Class3,34.439,824,90527.929,Class3,34.429,861,44907.948,Class3,34.43,947,243354.64,Class4,34.43,884,105208.31,Class4,34.43,926,188933.756,Class4,34.43,869,54466.517
Nonanoic acid,567,774.5,34.514,8,60,Class2,34.554,761,139653.781,Class2,34.554,757,306712.957,,0,0,,,0,0,,,0,0,,Class3,34.536,758,194133.954,Class4,34.581,746,456154.013,,0,0,,Class4,34.51,799,1447412.09
unknown,568,588,34.59,3,115,,0,0,,Class2,34.576,474,87999.82,Class2,34.603,693,23837.596,,0,0,,,0,0,,,0,0,,,0,0,,Class4,34.59,597,132418.786,,0,0,
"Hexadecanoic acid, methyl ester",569,777.6667,34.582,12,74,Class2,34.589,782,151582.982,Class2,34.581,791,258767.222,Class2,34.581,716,284854.877,Class3,34.585,801,284754.723,Class3,34.581,885,236357.68,Class3,34.581,843,242579.323,Class4,34.585,890,243446.575,Class4,34.581,817,304848.823,Class4,34.581,807,227603.516
"Benzenemethanol, 2-chloro-",570,588.1,34.661,10,142,Class2,34.66,545,9417.974,Class2,34.656,675,16429.311,Class2,34.669,501,15989.731,Class3,34.661,711,16841.758,Class3,34.66,573,13679.88,Class3,34.652,786,16472.98,Class4,34.665,482,10857.843,Class4,34.665,627,19209.075,Class4,34.665,487,15072.923
Methyl hexadec-9-enoate,571,856.8,35.06,10,74,Class2,35.06,852,45541.977,Class2,35.06,900,90624.603,Class2,35.06,919,113288.406,Class3,35.06,906,105269.753,Class3,35.056,886,83061.63,Class3,35.06,879,69468.079,Class4,35.06,911,88430.411,Class4,35.06,815,84144.741,Class4,35.06,872,74712.269
"Methyl 2,3,4,6,7-penta-O-methyl-L-glycero-D-mannoheptopyranoside",572,618.8571,35.263,7,88,Class2,35.265,530,16670.06,Class2,35.265,665,50641.087,Class2,35.269,605,32432.301,Class3,35.26,679,74860.218,Class3,35.265,676,56300.567,Class3,35.256,637,45104.801,,0,0,,,0,0,,Class4,35.265,540,13920.494
"9-Hexadecenoic acid, methyl ester, (Z)-",573,598.3333,35.288,6,97,,0,0,,Class2,35.282,552,9965.896,Class2,35.282,657,11631.217,Class3,35.291,597,5111.035,Class3,35.291,543,11039.937,Class3,35.291,564,7813.255,,0,0,,Class4,35.287,677,6503.512,,0,0,
1-Propyl-1-cyclopentanol,574,553,35.34,3,86,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"2,6,10-Dodecatrienal, 3,7,11-trimethyl-, (E,E)-",575,484.625,35.379,8,69,Class2,35.38,480,33737.896,Class2,35.376,457,28769.538,,0,0,,,0,0,,,0,0,,Class3,35.38,528,32769.422,Class4,35.376,379,23102.165,Class4,35.38,478,34980.92,Class4,35.38,430,19334.039
"1H-Pyrrole-2,5-dione, 3-ethyl-4-methyl-",576,683.75,35.402,12,139,Class2,35.402,765,81355.096,Class2,35.402,666,79778.605,Class2,35.398,702,108825.55,Class3,35.402,0,126288.527,Class3,35.402,691,66570.531,Class3,35.402,0,102859.175,Class4,35.402,0,86962.939,Class4,35.402,0,146673.874,Class4,35.402,751,98385.975
"1H-Pyrazole, 3,5-bis(1,1-dimethylethyl)-4-ethyl-",577,548,35.687,12,193,Class2,35.691,578,44148.079,Class2,35.687,498,30935.678,Class2,35.687,579,34755.97,Class3,35.687,584,39759.144,Class3,35.687,520,27591.18,Class3,35.682,545,20581.587,Class4,35.691,531,24575.323,Class4,35.678,551,36875.756,Class4,35.691,551,32430.578
Ethyl 9-hexadecenoate,578,684.8333,35.719,6,101,,0,0,,Class2,35.722,819,15680.073,Class2,35.713,589,11731.637,Class3,35.718,760,24793.01,Class3,35.727,738,15422.504,Class3,35.722,626,11524.309,Class4,35.709,577,9419.401,,0,0,,,0,0,
"2-(E)-Hexen-1-ol, (4S)-4-amino-5-methyl-",579,514.3333,35.732,3,86,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
O-Trifluoroacetyl-neomenthol,580,490.5556,35.867,9,71,,0,0,,Class2,35.878,410,12265.042,Class2,35.869,430,34429.194,Class3,35.864,469,33895.847,Class3,35.864,425,22154.324,Class3,35.864,580,26443.551,Class4,35.864,514,38277.007,Class4,35.873,478,51971.946,,0,0,
"1,2-Benzenedicarbonitrile",581,625.0909,35.895,11,163,Class2,35.895,429,30401.231,Class2,35.895,759,28142.125,Class2,35.891,921,25850.839,Class3,35.891,900,26961.289,Class3,35.886,785,22343.52,Class3,35.9,540,42353.552,Class4,35.896,526,31579.188,Class4,35.9,505,30359.978,,0,0,
2-Ethylhexyl salicylate,582,669.9091,35.958,11,120,Class2,35.962,721,26494.794,Class2,35.958,490,16241.244,Class2,35.958,712,23449.737,Class3,35.958,665,29735.924,Class3,35.962,591,10839.707,,0,0,,Class4,35.958,603,22489.159,Class4,35.958,541,15262.035,Class4,35.953,589,23423.662
unknown,583,554.4286,36.045,9,119,,0,0,,Class2,36.046,0,8760.239,Class2,36.046,502,7715.339,Class3,36.047,528,12936.597,,0,0,,Class3,36.047,587,11897.48,Class4,36.038,522,9695.602,,0,0,,Class4,36.046,0,9798.184
"9,12-Octadecadienoic acid (Z,Z)-",584,762.875,36.126,8,67,,0,0,,Class2,36.131,769,29552.419,Class2,36.126,779,51569.298,Class3,36.122,697,33751.732,Class3,36.131,789,24596.104,Class3,36.127,784,32001.916,Class4,36.127,803,34309.4,Class4,36.127,746,45099.627,Class4,36.122,736,26324.46
unknown,585,514,36.204,7,281,Class2,36.202,512,63716.739,Class2,36.198,0,104565.561,Class2,36.211,516,115909.186,Class3,36.207,0,95772.83,,0,0,,Class3,36.207,0,78022.776,Class4,36.207,0,55494.432,,0,0,,Class4,36.198,0,33923.956
"2,4-Di-tert-butylphenol",586,780.3333,36.215,12,191,Class2,36.215,814,120796.549,Class2,36.211,834,149289.942,Class2,36.215,757,166815.706,Class3,36.215,646,84434.086,Class3,36.211,552,50586.688,Class3,36.215,802,111880.213,Class4,36.215,827,181111.382,Class4,36.215,824,136565.367,Class4,36.215,881,262341.343
"2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl-, (Z,E)-",587,588.75,36.304,9,69,Class2,36.304,553,20374.503,Class2,36.3,546,30094.473,Class2,36.313,657,38793,Class3,36.295,650,29162.588,Class3,36.308,0,21225.898,Class3,36.304,650,27447.92,Class4,36.304,510,23313.464,Class4,36.304,581,46661.455,Class4,36.304,563,30446.779
unknown,588,506.4,36.463,6,145,,0,0,,Class2,36.46,506,16412.077,Class2,36.46,0,9381.823,Class3,36.464,514,21232.449,Class3,36.468,568,16466.629,Class3,36.464,544,18641.331,Class4,36.464,400,6000.638,,0,0,,,0,0,
n-Decanoic acid,589,652,36.541,7,60,,0,0,,,0,0,,,0,0,,Class3,36.566,532,32836.297,,0,0,,Class3,36.571,480,33402.646,Class4,36.575,499,36197.76,,0,0,,Class4,36.593,598,58708.975
unknown,590,565.9167,36.532,12,74,Class2,36.531,669,116666.903,Class2,36.531,645,66664.867,Class2,36.535,570,45440.723,Class3,36.531,534,69415.677,Class3,36.531,535,46044.831,Class3,36.544,574,61116.911,Class4,36.526,508,40419.027,Class4,36.531,526,30473.238,Class4,36.531,529,54476.252
"Phenol, 4-(2-propenyl)-",591,813,36.586,9,134,Class2,36.588,866,176981.524,Class2,36.588,901,254032.197,Class2,36.588,826,50178.579,Class3,36.589,771,44244.844,Class3,36.588,593,11875.784,Class3,36.584,880,320491.288,Class4,36.584,827,151453.209,Class4,36.584,842,191999.438,Class4,36.584,811,98152.197
"2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (R)-",592,906.9091,36.662,12,111,Class2,36.659,909,548608.478,Class2,36.664,935,453234.892,Class2,36.659,933,461206.94,Class3,36.664,918,604313.786,Class3,36.664,896,261177.743,Class3,36.66,939,652488.047,Class4,36.66,915,503060.965,Class4,36.66,917,620579.711,Class4,36.659,0,581600.801
Acetyl eugenol,593,802,36.738,6,149,Class2,36.735,771,15452.344,Class2,36.744,834,24686.295,,0,0,,,0,0,,,0,0,,Class3,36.74,0,19582.931,Class4,36.735,814,22610.822,Class4,36.74,783,27712.596,Class4,36.735,808,21824.857
"2,5-Cyclohexadien-1-one, 4-diazo-",594,535.375,36.903,9,64,Class2,36.908,500,119254.172,Class2,36.904,540,160507.829,Class2,36.904,529,98100.116,Class3,36.904,599,165088.347,Class3,36.904,531,167903.103,Class3,36.899,525,125952.21,Class4,36.904,507,83429.486,Class4,36.899,0,141496.007,Class4,36.899,552,98325.821
"Oxacycloheptadec-8-en-2-one, (8Z)-",595,751.8333,36.967,6,82,Class2,36.97,778,233771.525,,0,0,,,0,0,,Class3,36.971,717,57183.918,,0,0,,Class3,36.966,756,288519.279,Class4,36.962,651,108021.161,Class4,36.966,856,452661.715,Class4,36.966,753,329581.652
"(2E,6E,10E)-3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraen-1-yl formate",596,664.8333,37,12,69,Class2,36.988,685,136135.711,Class2,37.006,587,66906.275,Class2,37.001,641,69155.286,Class3,37.006,695,84978.396,Class3,37.001,622,35676.528,Class3,36.979,519,56384.014,Class4,37.002,669,96579.212,Class4,37.002,723,197022.092,Class4,37.002,547,203644.546
1-(4-Fluorobenzyl) piperazine,597,497.1429,37.086,7,109,Class2,37.081,485,27083.104,,0,0,,Class2,37.09,460,15818.572,Class3,37.086,540,21315.93,,0,0,,Class3,37.086,520,25202.467,,0,0,,Class4,37.086,504,36441.412,,0,0,
"Tricyclo[5.4.0.0(2,8)]undec-9-ene, 2,6,6,9-tetramethyl-, (1R,2S,7R,8R)-",598,594.4167,37.254,12,119,Class2,37.255,595,31854.795,Class2,37.25,632,21256.672,Class2,37.255,546,15984.138,Class3,37.264,574,11714.652,Class3,37.259,567,7746.821,Class3,37.25,574,35493.723,Class4,37.25,511,22203.144,Class4,37.255,636,44342.61,Class4,37.255,653,39898.658
"Bicyclo[3.3.1]nonan-3-ol, exo-",599,625.8,37.619,5,122,Class2,37.623,671,34248.899,,0,0,,,0,0,,,0,0,,,0,0,,Class3,37.619,623,15998.544,Class4,37.624,553,10067.306,Class4,37.61,668,37393.834,Class4,37.619,614,17142.225
"Tricyclo[4.3.1.0(2,5)]decane",600,708,37.679,6,80,Class2,37.681,722,48383.718,,0,0,,,0,0,,Class3,37.677,663,25755.708,,0,0,,Class3,37.677,748,54205.405,Class4,37.681,642,16839.555,Class4,37.681,771,81273.249,Class4,37.677,702,47215.764
unknown,601,580.75,37.912,4,95,,0,0,,Class2,37.903,652,9100.045,Class2,37.908,739,12271.604,,0,0,,,0,0,,,0,0,,Class4,37.921,428,6208.597,,0,0,,Class4,37.917,504,8479.978
"Phenol, 4-chloro-",602,762,38.214,3,128,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
Homosalate,603,709.5,38.55,12,109,Class2,38.556,797,19469.518,Class2,38.547,466,8421.74,Class2,38.552,776,21463.607,Class3,38.547,764,23691.535,Class3,38.543,467,9929.242,Class3,38.552,826,20603.915,Class4,38.547,772,16184.211,Class4,38.547,612,9622.248,Class4,38.552,539,13971.845
"cis,cis-7,10,-Hexadecadienal",604,650,38.997,9,98,Class2,39,685,36295.965,Class2,39.005,605,35916.501,Class2,38.996,709,43000.647,Class3,38.996,708,48557.149,Class3,38.996,647,28883.662,Class3,38.996,720,39038.572,Class4,38.996,652,24639.871,Class4,38.996,514,29657.928,Class4,38.996,610,23123.966
unknown,605,660.5,39.307,6,81,,0,0,,Class2,39.311,565,10179.674,Class2,39.311,718,13529.915,,0,0,,Class3,39.307,682,9553.8,,0,0,,Class4,39.303,690,15405.48,Class4,39.298,631,13230.527,,0,0,
"1(3H)-Isobenzofuranone, 3-butylidene-",606,629.8,39.654,5,146,Class2,39.658,514,9938.128,Class2,39.653,437,4486.94,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
3-Butylisobenzofuran-1(3H)-one,607,826.8333,39.699,6,133,Class2,39.698,843,54120.297,Class2,39.702,809,37846.1,Class2,39.693,623,14150.142,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"Phenol, 2,6-dimethoxy-4-(2-propenyl)-",608,860.4286,39.957,8,179,Class2,39.955,868,16111.015,Class2,39.96,835,14252.403,Class2,39.96,850,20165.105,Class3,39.956,870,26128.411,,0,0,,Class3,39.956,887,14980.26,Class4,39.951,900,20169.246,Class4,39.96,813,19139.337,Class4,39.955,0,7137.88
"Phthalic acid, 6-ethyl-3-octyl isobutyl ester",609,913.2727,40.017,12,149,Class2,40.018,893,489066.774,Class2,40.018,865,532746.889,Class2,40.018,0,496838.602,Class3,40.018,948,591496.532,Class3,40.018,899,482378.711,Class3,40.018,936,537028.678,Class4,40.013,891,503853.581,Class4,40.018,949,510128.349,Class4,40.018,898,411497.808
"Acetamide, N-(phenylmethyl)-",610,614.5714,40.166,7,149,Class2,40.164,509,21430.843,,0,0,,Class2,40.164,712,32584.284,Class3,40.164,578,24677.309,Class3,40.169,660,21670.47,,0,0,,Class4,40.164,418,9896.443,Class4,40.169,764,23111.947,Class4,40.169,661,15249.183
Vanillin,611,679.4167,40.337,12,152,Class2,40.333,681,53219.514,Class2,40.333,492,42866.779,Class2,40.337,823,114801.807,Class3,40.342,829,82643.242,Class3,40.337,715,45618.147,Class3,40.342,748,37878.67,Class4,40.338,749,45389.29,Class4,40.342,684,49370,Class4,40.342,801,74847.207
"Methyl 8,11,14-heptadecatrienoate",612,698.2727,40.389,11,79,Class2,40.391,616,14343.076,Class2,40.386,678,20415.135,Class2,40.391,747,26300.571,Class3,40.382,665,23762.132,Class3,40.391,723,22241.702,Class3,40.391,800,23139.107,Class4,40.386,756,27613.339,Class4,40.391,794,25735.182,Class4,40.386,717,24097.942
"2-Hydroxy-4,4,6-trimethylcyclohexa-2,5-dienone",613,541.1429,40.492,7,109,Class2,40.493,540,15957.904,Class2,40.493,622,27424.146,Class2,40.493,521,28881.461,,0,0,,,0,0,,Class3,40.498,562,16181.633,Class4,40.489,514,14256.077,Class4,40.493,566,18999.593,Class4,40.489,463,19207.675
Behenic alcohol,614,650,40.795,3,83,,0,0,,,0,0,,,0,0,,,0,0,,Class3,40.795,798,16863.281,,0,0,,,0,0,,,0,0,,,0,0,
Phytol,615,900.9167,41.217,12,71,Class2,41.217,915,571184.217,Class2,41.217,922,380787.017,Class2,41.217,929,587773.514,Class3,41.217,890,499629.148,Class3,41.217,887,338698.061,Class3,41.217,875,373334.107,Class4,41.217,897,263046.907,Class4,41.222,898,483324.969,Class4,41.217,874,423562.763
"2-Cyclohexen-1-one, 4-(3-hydroxy-1-butenyl)-3,5,5-trimethyl-",616,693,41.464,8,108,Class2,41.466,773,79804.648,,0,0,,Class2,41.461,718,35324.776,Class3,41.466,737,61154.285,Class3,41.461,667,27146.43,Class3,41.466,664,35769.022,Class4,41.466,592,25011.471,Class4,41.466,665,24685.035,Class4,41.461,728,56727.621
"2-Amino-4-benzylthiomethyl-6-piperidino-1,3,5-triazine",617,533,42.166,10,193,Class2,42.163,548,24075.408,Class2,42.163,559,35756.063,Class2,42.168,0,39112.36,Class3,42.168,489,36757.147,Class3,42.172,608,22748.475,Class3,42.172,535,22287.029,Class4,42.172,519,20095.872,Class4,42.159,546,27215.768,Class4,42.163,553,32498.122
Dibutyl phthalate,618,942.3333,42.436,12,149,Class2,42.434,947,1095683.39,Class2,42.434,942,1507558.03,Class2,42.438,944,1279890.38,Class3,42.434,952,1817445.76,Class3,42.438,952,1951398.82,Class3,42.434,926,1237585,Class4,42.434,951,1332585.7,Class4,42.439,949,1218197.73,Class4,42.434,940,727920.294
2-Tertbutyl cyclohexyl isopropylphosphonofluoridate,619,785.5455,42.835,12,127,Class2,42.834,808,611185.924,Class2,42.834,751,280560.506,Class2,42.834,782,440486.279,Class3,42.834,817,647038.973,Class3,42.834,734,124699.075,Class3,42.838,754,294483.945,Class4,42.834,788,242746.813,Class4,42.838,0,383098.87,Class4,42.834,817,482712.221
"3-Buten-2-one, 4-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-",620,639,42.844,3,123,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,
"1,2-Benzenediol, 3,5-bis(1,1-dimethylethyl)-",621,758.5714,44.947,8,207,,0,0,,Class2,44.948,773,73181.691,Class2,44.944,778,99196.797,Class3,44.944,784,92089.663,Class3,44.953,660,60858.391,Class3,44.948,802,75541.079,Class4,44.948,0,80048.963,Class4,44.94,719,56623.721,,0,0,
n-Hexadecanoic acid,622,736.1111,46.734,9,60,Class2,46.716,616,149358.902,,0,0,,,0,0,,Class3,46.739,728,74845.69,Class3,46.809,679,15429.363,Class3,46.752,799,107897.275,Class4,46.739,779,135911.066,Class4,46.712,713,40007.844,Class4,46.721,807,232516.271
Palmitoleic acid,623,803.5,47.383,8,84,Class2,47.382,0,59343.901,Class2,47.391,0,22977.494,Class2,47.356,801,118279.672,Class3,47.369,752,135965.375,,0,0,,Class3,47.396,787,106309.152,Class4,47.365,819,209797.719,Class4,47.418,832,70892.279,Class4,47.383,830,118392.079
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol,624,540,49.655,3,177,Class2,49.67,434,3280.535,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,,,0,0,