Table 3.
Input mass | Adduct | Mass | Database matcha | Formula | p (Limma) |
---|---|---|---|---|---|
241.0306778 | [M + H]+ | 240.0238 | Cystine | C6H12N2O4S2 | 0.001 |
1033.273196 | [M + H-2H2O]+ | 1068.2864 | 2-O-beta-d-Glucopyranuronosyl-d-mannose | C36H60O36 | 0.03 |
1041.978368 | [M + H]+ | 1040.9711 | TG(21:0/22:1(13Z)/22:1(13Z))[iso3] | C68H128O6 | 0.0003 |
354.9312674 | [M + NH4]+ | 336.8949 | 3,5-Dibromo-l-tyrosine | C9H9Br2NO3 | 0.0001 |
570.3873606 | [M + Na]+ | 547.4002 | PC(O-3:1(1E)/O-18:1(9Z))[S] | C29H58NO6P | 0.0007 |
1189.600044 | [M + H]+ | 1188.5928 | Camelliasaponin A1 | C58H92O25 | 0.0009 |
1203.845241 | [M + H]+ | 1202.8380 | GalNAcbeta1-4Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z)) | C64H118N2O18 | 2.77*10−5 |
481.2527897 | [M + Na]+ | 458.2603 | N-(4-benzenesulfonamide) arachidonoyl amine | C26H38N2O3S | 0.0026 |
541.8433866 | No match | 0.0025 | |||
393.2172688 | [M + H]+ | 392.2100 | Indacaterol | C24H28N2O3 | 0.0022 |
529.8652782 | No match | 9.96*10−7 | |||
272.1645049 | [M + H]+ | 271.1572 | Apoatropine | C17H21NO2 | 0.0023 |
aMatched in Metin at 10 ppm