MSI_000040958

Reliable

排名分数: 1.72
参考来源: Posidonia oceanica (PO:0006036: root epidermis)

M/z: 543.9735
Mass Window: 543.9732 ~ 543.9739 (2.6 ppm)

参考注释

(3s)-4,4,4-trichloro-3-methyl-n-[(1s,3s)-4,4,4-trichloro-3-methyl-1-{methyl[(1r)-1-(1,3-thiazol-2-yl)ethyl]carbamoyl}butyl]butanimidic acid_[M+H]+ (BioDeep_00002145243)
(3s)-4,4,4-trichloro-3-methyl-n-[(1s,3s)-4,4,4-trichloro-3-methyl-1-{methyl[(1r)-1-(1,3-thiazol-2-yl)ethyl]carbamoyl}butyl]butanimidic acid

Formula: C17H23Cl6N3O2S (542.9642078)
SMILES: C[C@@H](CC(O)=N[C@@H](C[C@H](C)C(Cl)(Cl)Cl)C(=O)N(C)[C@H](C)c1nccs1)C(Cl)(Cl)Cl