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. 2018 Apr 19;118(10):1349–1358. doi: 10.1038/s41416-018-0048-3

Table 1.

Tentative lipid assignments for the top three significant lipids in each model

Model m/z Lipid Configuration Ion
Cancer vs Normal 673.481 Phosphatidic acid PA(34:1) [M − H]
699.497 Phosphatidic acid/Phosphatidyl-ethanolamine PA(36:2 / PE(34:1) [M − H]/[M − NH3]
744.555 Phosphatidyl-ethanolamine PE(36:1) [M − H]
Cancer vs BOT 699.497 Phosphatidic acid/Phosphatidyl-ethanolamine PA(36:2 / PE(34:1) [M − H]/[M − NH3]
742.539 Phosphatidyl-ethanolamine PE(36:2) [M – H]
685.517 Phosphatidic-acid-plasmalogen PA(P-36:1) [M − H]

Tandem MS and LipidMAPS used along with locally derived lipid data sets from previous REIMS work to tentatively assign lipid classifications and configurations. PA phosphatidic acid, PE phosphatidyl-ethanolamine