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Analysis: None NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
PS(10:0/10:0)PS 10:0/10:0ME169956---567.3172
PS(12:0/0:0)LPS 12:0/0:0ME169940---441.2128
PS(12:0/12:0)PS 12:0/12:0ME169926---623.3798
PS(12:0/13:0)PS 12:0/13:0*ME169958---637.3955
PS(12:0/14:1(9Z))PS 12:0/14:1(9Z)ME169927---649.3955
PS(12:0/15:0)PS 12:0/15:0ME169960---665.4268
PS(12:0/15:1(9Z))PS 12:0/15:1(9Z)*ME169959---663.4111
PS(12:0/16:1(9Z))PS 12:0/16:1(9Z)*ME169962---677.4268
PS(12:0/17:0)PS 12:0/17:0*ME169965---693.4581
PS(12:0/17:2(9Z,12Z))PS 12:0/17:2(9Z,12Z)*ME169964---689.4268
PS(12:0/18:2(9Z,12Z))PS 12:0/18:2(9Z,12Z)*ME169966---703.4424
PS(12:0/18:3(6Z,9Z,12Z))PS 12:0/18:3(6Z,9Z,12Z)*ME170001---701.4268
PS(12:0/18:4(6Z,9Z,12Z,15Z))PS 12:0/18:4(6Z,9Z,12Z,15Z)*ME170008---699.4111
PS(12:0/19:0)PS 12:0/19:0ME169969---721.4894
PS(12:0/20:1(11Z))PS 12:0/20:1(11Z)*ME170010---733.4894
PS(12:0/20:2(11Z,14Z))PS 12:0/20:2(11Z,14Z)*ME169971---731.4737
PS(12:0/20:3(8Z,11Z,14Z))PS 12:0/20:3(8Z,11Z,14Z)*ME169970---729.4581
PS(12:0/20:4(5Z,8Z,11Z,14Z))PS 12:0/20:4(5Z,8Z,11Z,14Z)*ME170009---727.4424
PS(12:0/21:0)PS 12:0/21:0*ME169977---749.5207
PS(12:0/22:2(13Z,16Z))PS 12:0/22:2(13Z,16Z)*ME169996---759.505
PS(12:0/22:4(7Z,10Z,13Z,16Z))PS 12:0/22:4(7Z,10Z,13Z,16Z)*ME169978---755.4737
PS(13:0/17:1(9Z))PS 13:0/17:1(9Z)*ME169967---705.4581
PS(13:0/18:2(9Z,12Z))PS 13:0/18:2(9Z,12Z)*ME170015---717.4581
PS(13:0/18:3(6Z,9Z,12Z))PS 13:0/18:3(6Z,9Z,12Z)*ME170012---715.4424
PS(13:0/18:4(6Z,9Z,12Z,15Z))PS 13:0/18:4(6Z,9Z,12Z,15Z)*ME170014---713.4268
PS(13:0/20:1(11Z))PS 13:0/20:1(11Z)*ME169976---747.505
PS(13:0/20:2(11Z,14Z))PS 13:0/20:2(11Z,14Z)*ME169975---745.4894
PS(13:0/20:3(8Z,11Z,14Z))PS 13:0/20:3(8Z,11Z,14Z)*ME169974---743.4737
PS(13:0/20:4(5Z,8Z,11Z,14Z))PS 13:0/20:4(5Z,8Z,11Z,14Z)*ME169973---741.4581
PS(13:0/22:0)PS 13:0/22:0ME169981---777.552
PS(13:0/22:1(11Z))PS 13:0/22:1(11Z)*ME170002---775.5363
PS(13:0/22:2(13Z,16Z))PS 13:0/22:2(13Z,16Z)*ME169997---773.5207
PS(13:0/22:4(7Z,10Z,13Z,16Z))PS 13:0/22:4(7Z,10Z,13Z,16Z)*ME169980---769.4894
PS(14:0/0:0)LPS 14:0/0:0*ME169920---469.2441
PS(14:0/14:0)PS 14:0/14:0ME169963---679.4424
PS(14:1(9Z)/0:0)PS 14:1(9Z)/0:0ME169942---467.2284
PS(14:1(9Z)/14:1(9Z))PS 14:1(9Z)/14:1(9Z)ME169961---675.4111
PS(15:0/0:0)LPS 15:0/0:0ME169944---483.2597
PS(15:0/22:1(11Z))PS 15:0/22:1(11Z)*ME169998---803.5676
PS(15:1(9Z)/0:0)PS 15:1(9Z)/0:0*ME169943---481.2441
PS(16:0/0:0)LPS 16:0/0:0ME169945---497.2754
PS(16:0/16:0)PS 16:0/16:0ME169972---735.505
PS(16:0/18:1(11Z))PS 16:0/18:1(11Z)ME169979---761.5207
PS(16:0/20:0)PS 16:0/20:0ME170011---791.5676
PS(16:0/22:1(11Z))PS 16:0/22:1(11Z)ME169931---817.5833
PS(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))PS 16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME169929---807.505
PS(16:1(9Z)/0:0)PS 16:1(9Z)/0:0ME170003---495.2597
PS(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))PS 16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME170007---805.4894
PS(17:0/14:1(9Z))PS 17:0/14:1(9Z)*ME169968---719.4737
PS(17:0/20:4(5Z,8Z,11Z,14Z))PS 17:0/20:4(5Z,8Z,11Z,14Z)*ME169982---797.5207
PS(17:0/21:0)PS 17:0/21:0*ME170004---819.5989
PS(17:0/22:1(11Z))PS 17:0/22:1(11Z)ME169999---831.5989
PS(17:0/22:2(13Z,16Z))PS 17:0/22:2(13Z,16Z)*ME169983---829.5833
PS(17:0/22:4(7Z,10Z,13Z,16Z))PS 17:0/22:4(7Z,10Z,13Z,16Z)*ME169932---825.552
PS(17:2(9Z,12Z)/0:0)PS 17:2(9Z,12Z)/0:0*ME169946---507.2597
PS(18:0/0:0)LPS 18:0/0:0ME169950---525.3067
PS(18:0/12:0)PS 18:0/12:0*ME170005---707.4737
PS(18:0/18:1(9Z))PS 18:0/18:1(9Z)ME170013---789.552
PS(18:0/20:4(5Z,8Z,11Z,14Z))PS 18:0/20:4(5Z,8Z,11Z,14Z)*ME169930---811.5363
PS(18:0/22:1(11Z))PS 18:0/22:1(11Z)ME169985---845.6146
PS(18:0/22:2(13Z,16Z))PS 18:0/22:2(13Z,16Z)*ME169984---843.5989
PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))PS 18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME169934---835.5363
PS(18:1(9Z)/0:0)PS 18:1(9Z)/0:0ME169949---523.291
PS(18:1(9Z)/22:2(13Z,16Z))PS 18:1(9Z)/22:2(13Z,16Z)*ME169935---841.5833
PS(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))PS 18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME169933---833.5207
PS(18:2(9Z,12Z)/0:0)PS 18:2(9Z,12Z)/0:0*ME169922---521.2754
PS(18:2(9Z,12Z)/18:2(9Z,12Z))PS 18:2(9Z,12Z)/18:2(9Z,12Z)*ME169928---783.505
PS(18:3(6Z,9Z,12Z)/0:0)PS 18:3(6Z,9Z,12Z)/0:0*ME169921---519.2597
PS(18:4(6Z,9Z,12Z,15Z)/0:0)PS 18:4(6Z,9Z,12Z,15Z)/0:0*ME169948---517.2441
PS(19:0/21:0)PS 19:0/21:0*ME169986---847.6302
PS(19:0/22:0)PS 19:0/22:0*ME169937---861.6459
PS(19:0/22:1(11Z))PS 19:0/22:1(11Z)*ME170000---859.6302
PS(19:0/22:2(13Z,16Z))PS 19:0/22:2(13Z,16Z)*ME169987---857.6146
PS(19:0/22:4(7Z,10Z,13Z,16Z))PS 19:0/22:4(7Z,10Z,13Z,16Z)*ME169936---853.5833
PS(19:1(9Z)/0:0)PS 19:1(9Z)/0:0ME169951---537.3067
PS(20:0/0:0)LPS 20:0/0:0ME169955---553.338
PS(20:0/22:1(11Z))PS 20:0/22:1(11Z)ME169939---873.6459
PS(20:0/22:2(13Z,16Z))PS 20:0/22:2(13Z,16Z)*ME169988---871.6302
PS(20:0/22:4(7Z,10Z,13Z,16Z))PS 20:0/22:4(7Z,10Z,13Z,16Z)*ME169938---867.5989
PS(20:1(11Z)/0:0)PS 20:1(11Z)/0:0ME169954---551.3223
PS(20:4(5Z,8Z,11Z,14Z)/0:0)PS 20:4(5Z,8Z,11Z,14Z)/0:0*ME169953---545.2754
PS(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)PS 20:5(5Z,8Z,11Z,14Z,17Z)/0:0*ME169952---543.2597
PS(21:0/22:0)PS 21:0/22:0ME169993---889.6772
PS(21:0/22:1(11Z))PS 21:0/22:1(11Z)*ME169992---887.6615
PS(21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))PS 21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME169989---877.5833
PS(22:0/0:0)LPS 22:0/0:0ME169925---581.3693
PS(22:0/22:0)PS 22:0/22:0ME170006---903.6928
PS(22:0/22:1(11Z))PS 22:0/22:1(11Z)ME169995---901.6772
PS(22:0/22:2(13Z,16Z))PS 22:0/22:2(13Z,16Z)*ME170016---899.6615
PS(22:0/22:4(7Z,10Z,13Z,16Z))PS 22:0/22:4(7Z,10Z,13Z,16Z)*ME169994---895.6302
PS(22:1(11Z)/0:0)PS 22:1(11Z)/0:0ME169924---579.3536
PS(22:4(7Z,10Z,13Z,16Z)/0:0)PS 22:4(7Z,10Z,13Z,16Z)/0:0*ME169923---573.3067
PS(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z...PS 22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME169991---882.5263
PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)PS 22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0*ME169957---569.2754
PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,...PS 22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*ME169990---882.5263
PS(6:0/6:0)PS 6:0/6:0*ME169941---455.192
PS(8:0/8:0)PS 8:0/8:0ME169947---511.2546


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