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Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Cer(d34:1)_M+H2CO2_feature1Cer 34:1;O2ME636919--5.77582.5086266
Cer(d36:1)_M+H2CO2_feature1Cer 36:1;O2ME636918--6.74610.5401966
Cer(d40:1)_M+H2CO2_feature1Cer 40:1;O2ME636917--7.58666.6034466
Cer(d41:1)_M+H2CO2_feature1Cer 41:1;O2ME636916--7.74680.6192866
Cer(d42:0-OH)_M+H2CO2_feature1Cer 42:0;O3ME636915--7.73712.6454266
Cer(d42:1)_feature1Cer 42:1;O2ME636914--7.9648.6297166
Cer(d42:2)_feature1Cer 42:2;O2ME636913--7.54646.6136266
Cer(d43:1)_M+H2CO2_feature1Cer 43:1;O2ME636912--8.08708.6506466
Cholesterol sulfate_feature1Cholesterol sulfateME636911--3.26465.3028466
FA(14:1-OH)_feature2FA 14:1;O*ME636910--2.1241.1792766
FA(18:1-2OH)_feature12-Hydroxyoctadecenoic acidME636909--2.38313.2369366
FA(18:2-2OH)_feature12-Hydroxyoctadecadienoic acidME636908--2.13311.2213966
FA(20:4)_feature1Arachidonic acidME636907--2.91303.2313266
FA(20:5)_feature1Eicosapentaenoic acidME636906--2.73301.2158266
FA(22:6)_feature1DHAME636905--2.84327.2313466
GTInternalStandard_PC(18:1(d7))>PC(18:1(9z,d7)/...-ME636783--2.6573.3883766
GTInternalStandard_PC(33:1(d7))>PC(15:0/18:1(9z...-ME636782--5.25797.6040966
GTInternalStandard_PE(18:1(d7))>PE(18:1(9z,d7)/...-ME636781--2.64485.3361866
GTInternalStandard_PE(33:1(d7))>PE(15:0/18:1(9z...-ME636780--5.48709.5511966
GTInternalStandard_PG(33:1(d7))>PG(15:0/18:1(9z...-ME636779--4.87740.5459466
GTInternalStandard_PI(33:1(d7))>PI(15:0/18:1(9z...-ME636785--4.69828.5651666
GTInternalStandard_PS(33:1(d7))>PS(15:0/18:1(9z...-ME636784--4.78753.5400766
GTInternalStandard_SM(d36:2(d9))>SM(d18:1/18:1(...-ME636778--4.87782.6373466
HexCer(d40:1)_M+H2CO2_feature2HexCer 40:1;O2ME636904--7.3828.6567066
HexCer(d41:1)_M+H2CO2_feature1HexCer 41:1;O2ME636903--7.44842.6723666
HexCer(d42:0-OH)_M+H2CO2_feature2HexCer 42:0;O3ME636902--7.44874.6983866
HexCer(d42:2)_M+H2CO2_feature3HexCer 42:2;O2ME636901--7.27854.6720766
LPC(14:0)_feature1and2LPC 14:0ME636900--2.08512.2978666
LPC(16:0)_feature2LPC 16:0ME636898--2.54540.3294466
LPC(16:0)_lp_aLPC 16:0ME636899--2.46540.3294366
LPC(16:1)_feature2LPC 16:1ME636897--2.19538.3136566
LPC(17:0)_feature1and2LPC 17:0ME636896--2.72554.3452466
LPC(18:0)_feature2LPC 18:0ME636895--2.87568.3609366
LPC(18:1/0:0)_and_LPC(0:0/18:1)_M+H2CO2_feature1an...LPC 18:1ME636894--2.61566.3451966
LPC(18:2)_feature2LPC 18:2ME636893--2.32564.3295466
LPC(20:1)_feature2LPC 20:1ME636892--2.89594.3756766
LPC(20:2)_feature2LPC 20:2ME636891--2.68592.3608066
LPC(20:3)_feature2LPC 20:3ME636890--2.47590.3451566
LPC(20:4)_feature2LPC 20:4ME636889--2.29588.3296766
LPC(20:5)_feature1and2LPC 20:5ME636888--2.03586.3138466
LPC(22:0)_feature2LPC 22:0ME636887--3.69624.4236266
LPC(22:5)_feature2LPC 22:5ME636886--2.36614.3447566
LPC(22:6)_feature2LPC 22:6ME636885--2.23612.3296266
LPE(16:0)_feature1and2LPE 16:0ME636884--2.59452.2764766
LPE(18:0)_feature2LPE 18:0ME636883--2.91480.3077266
LPE(20:0)_feature2LPE 20:0ME636882--2.87508.3389466
LPE(20:4)_feature2LPE 20:4ME636881--2.33500.2764566
LPE(22:6)_feature2LPE 22:6ME636880--2.27524.2762666
LPE(O-15:0)_feature1LPE O-15:0ME636879--2.64424.2835566
PC(32:0)>PC(16:0_16:0)_M+H2CO2_feature2PC 16:0/16:0ME636878--5.65778.5600266
PC(32:1)>PC(14:0_18:1)_and_PC(16:0_16:1)_M+H2CO...PC 32:1ME636877--4.88776.5436766
PC(32:2)>PC(14:0_18:2)_M+H2CO2_feature1PC 14:0_18:2ME636876--4.32774.5284966
PC(34:0)>PC(16:0/18:0)_M+H2CO2_feature4PC 16:0/18:0ME636875--6.61806.5916766
PC(34:1)>PC(16:0_18:1)_M+H2CO2_feature2PC 16:0_18:1ME636874--5.72804.5765866
PC(34:2)>PC(16:0_18:2)_M+H2CO2_feature1PC 16:0_18:2ME636873--5.06802.5607866
PC(34:3)>PC(16:0_18:3)_M+H2CO2_feature3PC 16:0_18:3ME636872--4.67800.5443166
PC(34:3)>PC(16:1_18:2)_M+H2CO2_feature2PC 16:1_18:2ME636871--4.41800.5441766
PC(34:4)>PC(14:0_20:4)_M+H2CO2_feature3PC 14:0_20:4ME636870--4.22798.5286066
PC(35:2)>PC(17:0_18:2)_M+H2CO2_feature1PC 17:0_18:2ME636869--5.34816.5758666
PC(35:2)>PC(17:0_18:2)_M+H2CO2_feature2PC 17:0_18:2ME636868--5.5816.5757966
PC(35:4)>PC(15:0_20:4)_M+H2CO2_feature2PC 15:0_20:4ME636867--4.55812.5440666
PC(36:0)>PC(18:0/18:0)_M+H2CO2_feature2PC 18:0/18:0ME636866--7.2834.6224566
PC(36:1)>PC(16:0_20:1)_and_PC(18:0_18:1)_M+H2CO...PC 36:1ME636865--6.67832.6078866
PC(36:2)>PC(18:0_18:2)_M+H2CO2_feature3PC 18:0_18:2ME636864--5.96830.5925566
PC(36:3)>PC(16:0_20:3)_M+H2CO2_feature5PC 16:0_20:3ME636863--5.51828.5752566
PC(36:3)>PC(18:1_18:2)_M+H2CO2_feature2PC 18:1_18:2ME636862--5.11828.5753866
PC(36:4)>PC(18:2/18:2)_M+H2CO2_feature2PC 18:2/18:2ME636861--4.53826.5608566
PC(36:5)>PC(16:0_20:5)_M+H2CO2_feature3PC 16:0_20:5ME636860--4.47824.5440066
PC(36:5)>PC(16:1_20:4)_M+H2CO2_feature2PC 16:1_20:4ME636859--4.29824.5440366
PC(37:4)>PC(17:0_20:4)_M+H2CO2_feature2PC 17:0_20:4ME636857--5.2840.5754466
PC(37:4)>PC(17:0_20:4)_M+H2CO2_feature3PC 17:0_20:4ME636858--5.36840.5755066
PC(38:2)>PC(18:0_20:2)_M+H2CO2_feature3PC 18:0_20:2ME636856--6.78858.6224566
PC(38:3)>PC(18:0_20:3)_M+H2CO2_feature3PC 18:0_20:3ME636855--6.21856.6075666
PC(38:4)>PC(18:0_20:4)_M+H2CO2_feature4PC 18:0_20:4ME636854--5.81854.5923366
PC(38:5)>PC(16:0_22:5)_and_PC(18:1_20:4)_M+H2CO...PC 38:5ME636852--4.97852.5752766
PC(38:5)>PC(16:0_22:5)_M+H2CO2_feature2PC 16:0_22:5ME636853--4.68852.5750766
PC(38:6)>PC(16:0_22:6)_and_PC(18:0_20:6)_M+H2CO...PC 38:6ME636851--4.73850.5607766
PC(38:6)>PC(18:2_20:4)_M+H2CO2_feature1PC 18:2_20:4ME636850--4.42850.5607866
PC(39:4)>PC(19:0_20:4)_M+H2CO2_feature3PC 19:0_20:4ME636848--6.1868.6069066
PC(39:4)>PC(19:0_20:4)_M+H2CO2_feature5PC 19:0_20:4ME636849--6.31868.6069066
PC(40:4)>PC(18:0_22:4)_M+H2CO2_feature2PC 18:0_22:4ME636847--6.46882.6229666
PC(40:4)>PC(20:0_20:4)_M+H2CO2_feature3PC 20:0_20:4ME636846--6.78882.6229466
PC(40:5)>PC(18:0_22:5)_M+H2CO2_feature3PC 18:0_22:5ME636844--5.86880.6060066
PC(40:5)>PC(18:0_22:5)_M+H2CO2_feature4PC 18:0_22:5ME636845--6.18880.6060066
PC(40:6)>PC(18:0_22:6)_M+H2CO2_feature3PC 18:0_22:6ME636843--5.58878.5925466
PC(40:7)>PC(18:1_22:6)_M+H2CO2_feature3PC 18:1_22:6ME636842--4.77876.5747766
PC(40:8)>PC(20:4_20:4)_M+H2CO2_feature1PC 20:4/20:4ME636841--4.28874.5602966
PC(42:10)>PC(20:4_22:6)_M+H2CO2_feature1PC 20:4_22:6ME636840--4.12898.5601566
PC(O-34:1)_feature2PC O-34:1ME636839--6.3790.5963366
PC(O-36:4)>PC(O-16:0/20:4) M+ H2CO2_feature4PC O-16:0/20:4ME636838--5.47812.5809266
PC(O-36:5)>PC(O-16:1/20:4)_M+H2CO2_feature5PC O-16:1/20:4ME636837--5.32810.5641366
PC(O-38:4)>PC(O-18:0/20:4)_M+H2CO2_feature6PC O-18:0/20:4ME636836--6.44840.6121266
PC(O-38:5)>PC(O-18:1/20:4)_M+H2CO2_feature1PC O-18:1/20:4ME636834--5.5838.5963366
PC(O-40:4)>PC(O-20:0/20:4)_M+H2CO2_feature2PC O-20:0/20:4ME636835--7.15868.6431066
PE(34:2)>PE(16:0_18:2)_feature2PE 16:0_18:2ME636833--5.31714.5064566
PE(36:2)>PE(18:0_18:2)_feature2PE 18:0_18:2ME636832--6.22742.5386866
PE(36:4)>(16:0_20:4)_feature3-ME636831--5.15738.5069366
PE(38:4)>PE(18:0_20:4)_feature5PE 18:0_20:4ME636830--6.07766.5389066
PE(38:5)>PE(16:0_22:5)_and_PE(38:5)>PE(18:1_...PE 38:5ME636829--5.19764.5222066
PE(38:6)>PE(16:0_22:6)_feature3PE 16:0_22:6ME636828--4.94762.5062566
PE(40:6)>PE(18:0_22:6)_feature2PE 18:0_22:6ME636827--5.83790.5376866
PE(O-36:5)>PE(O-16:1/20:4)_feature3PE O-16:1/20:4ME636826--5.57722.5119966
PE(O-38:4)>PE(O-18:0/20:4)_and_PE(O-18:2/20:2)_...PE O-38:4ME636825--6.7752.5590466
PE(O-38:5)>PE(O-16:1/22:4)_feature5PE O-16:1/22:4ME636824--6.22750.5441166
PE(O-38:5)>PE(O-18:1/20:4)_feature6PE O-18:1/20:4ME636823--6.53750.5441166
PE(O-38:6)>PE(O-18:2/20:4)_and_PE(O-16:1/22:5)_...PE O-38:6ME636822--5.62748.5276166
PE(O-38:7)>PE(O-16:1/22:6)_and_PE(O-20:7/18:0)_...PE O-38:7ME636821--5.33746.5118366
PE(O-40:3)>PE(O-18:0/22:3)_feature1PE O-18:0/22:3ME636816--7.24780.5904566
PE(O-40:4)>PE(O-18:0/22:4)_feature1PE O-18:0/22:4ME636820--7.12780.5905566
PE(O-40:4)>PE(O-20:0/20:4)_feature2PE O-20:0/20:4ME636815--7.18778.5751066
PE(O-40:5)>PE(O-18:1/22:4)_feature3PE O-18:1/22:4ME636819--7.04778.5752666
PE(O-40:7)>PE(O-18:1/22:6)_and_PE(O-22:7/18:0)_...PE O-40:7ME636818--6.27774.5437866
PE(O-42:5)>PE(O-20:1/22:4)_feature1PE O-20:1/22:4ME636817--7.37806.6061866
PI(34:2)>PI(16:0_18:2)_feature1PI 16:0_18:2ME636814--4.54833.5183266
PI(36:2)>PI(18:0_18:2)_feature2PI 18:0_18:2ME636813--5.33861.5496566
PI(36:3)>PI(18:1_18:2)_feature1PI 18:1_18:2ME636812--4.59859.5335466
PI(36:4)>PI(16:0_20:4)_feature1PI 16:0_20:4ME636811--4.45857.5184166
PI(38:3)>PI(18:0_20:3)_feature2PI 18:0_20:3ME636810--5.55887.5644966
PI(38:4)>PI(18:0_20:4)_feature3PI 18:0_20:4ME636809--5.21885.5505266
PI(38:5)>PI(18:1_20:4)_feature1PI 18:1_20:4ME636808--4.49883.5333966
PI(38:6)>PI(16:0_22:6)_feature1PI 16:0_22:6ME636807--4.29881.5177766
PI(40:5)>PI(18:0_22:5)_feature1PI 18:0_22:5ME636806--5.26911.5639266
PI(40:6)>PI(18:0_22:6)_feature2PI 18:0_22:6ME636805--5.02909.5484066
PS(38:4)>PS(18:0_20:4)_feature2PS 18:0_20:4ME636804--5.32810.5281066
PS(O-40:7)>PS(O-20:3/20:4)_feature2PS O-20:3/20:4ME636803--6.53818.5314366
SM(d34:0)_M+H2CO2_feature1SM 34:0;O2ME636802--5.1749.5800266
SM(d34:1)_M+H2CO2_feature1SM 34:1;O2ME636801--4.79747.5657766
SM(d34:2)_M+H2CO2_feature1SM 34:2;O2ME636800--4.2745.5500166
SM(d36:1)_M+H2CO2_feature1SM 36:1;O2ME636799--5.66775.5966466
SM(d36:2)_M+H2CO2_feature1SM 36:2;O2ME636798--4.93773.5798066
SM(d38:1)_M+H2CO2_feature2SM 38:1;O2ME636797--6.65803.6279266
SM(d40:0-OH)_M+H2CO2_feature1SM 40:0;O3ME636796--7.52849.6614266
SM(d40:1)_M+H2CO2_feature1SM 40:1;O2ME636795--7.23831.6600866
SM(d40:2)_M+H2CO2_feature1SM 40:2;O2ME636793--6.59829.6440966
SM(d40:2)_M+H2CO2_feature2SM 40:2;O2ME636794--6.83829.6441166
SM(d41:2)_M+H2CO2_feature1SM 41:2;O2ME636792--7.12843.6598166
SM(d42:1)_M+H2CO2_feature1SM 42:1;O2ME636791--7.52859.6917266
SM(d42:2)_M+H2CO2_feature1SM 42:2;O2ME636790--7.29857.6761366
SM(d42:3)_M+H2CO2_feature1SM 42:3;O2ME636789--6.72855.6597066
SM(d43:2)_M+H2CO2_feature1SM 43:2;O2ME636788--7.36871.6901766
SM(d44:2)_M+H2CO2_feature1SM 44:2;O2ME636787--7.48885.7059866
sphingosine-1P (C18)_feature1Sphingosine 1-phosphateME636786--2.19378.2399266


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