MSI_000015806

Reliable

排名分数: 3.35
参考来源: Vitis vinifera (PO:0009085: exocarp)

M/z: 489.0196
Mass Window: 489.0195 ~ 489.0197 (0.7 ppm)

参考注释

(20e)-4,6,23-trichloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,13,16,24-tetrol_[M+H-2H2O]+ (BioDeep_00002140072)
(20e)-4,6,23-trichloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,13,16,24-tetrol

Formula: C28H19Cl3O4 (524.0348864)
SMILES: Oc1ccc2cc1-c1cc(ccc1O)CCc1c(cc(Cl)c(O)c1Cl)-c1ccc(c(Cl)c1O)/C=C/2