MSI_000032818

Unreliable

排名分数: 1.31
参考来源: Posidonia oceanica (PO:0005020: vascular bundle)

M/z: 489.0022
Mass Window: 489.002 ~ 489.0024 (1.5 ppm)

参考注释

(2s,3s,5s)-5-bromo-2-[(1s,2s,4r,5r)-5-bromo-4-chloro-2-hydroxy-4-methylcyclohexyl]-2,6,6-trimethyloxan-3-yl acetate_[M+H]+ (BioDeep_00002077145)
(2s,3s,5s)-5-bromo-2-[(1s,2s,4r,5r)-5-bromo-4-chloro-2-hydroxy-4-methylcyclohexyl]-2,6,6-trimethyloxan-3-yl acetate

Formula: C17H27Br2ClO4 (487.99644920000003)
SMILES: CC(=O)O[C@H]1C[C@H](Br)C(C)(C)O[C@@]1(C)[C@H]1C[C@@H](Br)[C@](C)(Cl)C[C@@H]1O