| RTa (mins) | (M + H)+ | Product ions (m/z) | Formula | Exact mass | Diff (ppm) | Proposed compounds |
| 3.162 | 138.0548 | 94.0645, 92.0488, 78.0332, 65.0380, 53.0380 | C7H7NO2 | 138.0550 | 1.12 | 6-methylpicolinic acid | 3.481 | 130.0858 | 103.8087, 84.0803, 67.0534, 56.0491 | C6H11NO2 | 130.0863 | 3.50 | Pipecolic acid | 7.422 | 230.1739 | 212.1630, 194.1522, 95.0849, 70.0645 | C12H23NO3 | 230.1751 | 5.08 | 7-(5,6-dihydroxypiperidin-2-yl)heptan-2-one | 8.63 | 244.1905 | 226.1789, 208.1679, 185.0062, 95.0846, 70.0647 | C13H25NO3 | 244.1097 | 0.90 | 7-(5-hydroxy-6-(hydroxymethyl)piperidin-2-yl)heptan-2-one | 9.232 | 332.2790 | 314.2672, 296.2566, 260.2368, 236.2351, 70.0647 | C18H37NO4 | 332.2795 | 1.61 | Batzellaside A | 9.246 | 346.2572 | 328.2466, 310.2361, 264.2307, 70.0646 | C18H35NO5 | 346.2588 | 4.62 | Broussonetine C | 11.130 | 314.2678 | 296.2570, 278.2464, 236.2360, 135.1156, 95.0850, 70.0646 | C18H35NO3 | 314.2690 | 3.72 | (−)-7-hydroxycassine | 11.584 | 316.2833 | 298.2723, 280.2623, 236.2358, 198.1840, 149.1319, 95.0851, 70.0645 | C18H37NO3 | 316.2846 | 4.18 | Leptophyllin A | 12.609 | 342.2987 | 324.2889, 306.2780, 95.0849, 81.0693, 70.0648, 55.0538 | C20H39NO3 | 342.3003 | 4.59 | (−)-7-hydroxyspectaline | 13.231 | 300.2532 | 282.2411, 264.2309, 182.1526, 123.1158, 95.0849, 70.0648 | C17H33NO3 | 300.2533 | 0.40 | Leptophyllin B | 13.251 | 358.2942 | 298.2723, 280.2621, 198.1835, 95.0847, 70.0646 | C20H39NO4 | 358.2952 | 2.75 | 3-O-acetylleptophyllin A | 14.044 | 300.2890 | 282.2772, 264.2668, 236.2355, 182.1894, 95.0849, 70.0647 | C18H37NO2 | 300.2897 | 2.45 | (−)-6-iso-carnavaline | 14.385 | 298.2727 | 280.2627, 252.2303, 198.1837, 149.1310, 123.1158, 95.0848, 70.0645 | C18H35NO2 | 298.2741 | 4.55 | (−)-cassine | 16.015 | 328.3209 | 310.3082, 292.2978, 264.2665, 210.2197, 95.0848, 70.0645 | C20H41NO2 | 328.3210 | 0.32 | (−)-spectalinine | 16.419 | 326.3045 | 308.2932, 280.2612, 226.2148, 123.1156, 95.0848, 70.0645 | C20H39NO2 | 326.3054 | 2.62 | (−)-spectaline | 17.693 | 368.3139 | 326.3025, 308.2928, 226.2136, 95.0848, 70.0645 | C22H41NO3 | 368.3159 | 3.04 | (−)-3-O-acetylspectaline | 18.166 | 402.2986 | 280.2620, 252.2302, 212.1992, 184.1668, 149.1310, 70.0645 | C25H39NO3 | 402.3003 | 4.15 | 3(R)-benzoyl-2-(R)-methyl-6(R)-11′-oxododecyl)-piperidine | 18.467 | 300.2893 | 282.2772, 264.2666, 238.2507, 198.2194 | C18H37NO2 | 300.2897 | 1.35 | Sphingosine | 28.349 | 582.5430 | 564.5322, 546.8983, 298.2725, 280.2618, 70.0644 | C36H71NO4 | 582.5456 | 4.44 | N-(2-hydroxy-docosanoyl)-tetradecasphing-4-enine | 28.631 | 562.5163 | 453.3398, 340.2575, 264.2669, 69.0691 | C36H67NO3 | 562.5194 | 5.46 | N-(13Z-docosenoyl)-4E,6E-tetradecasphingadienine | 29.616 | 538.5174 | 520.5056, 264.2669, 114.0900, 70.0643 | C34H67NO3 | 538.5194 | 3.66 | N-palmitoylsphingosine | 31.276 | 608.5642 | 548.5366, 352.3180, 292.2976, 224.2333, 70.0643 | C38H73NO4 | 608.5612 | −4.87 | N-(2-hydroxy-tetracosanoyl)-4E,6E-tetradecasphingadienine |
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