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(4aS,6aS,12bS)-11-chloranyl-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6-hexahydrobenzo[a]xanthene-9,10-diol

View entire compound with spectra: 1 MS (GC)

(4aS,6aS,12bS)-11-chloranyl-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6-hexahydrobenzo[a]xanthene-9,10-diol
SpectraBase Compound ID BeVaX01wvmi
InChI InChI=1S/C21H27ClO3/c1-19(2)7-5-8-20(3)15(19)6-9-21(4)16(20)10-12-14(25-21)11-13(23)18(24)17(12)22/h10-11,15,23-24H,5-9H2,1-4H3/t15-,20-,21-/m0/s1
InChIKey OQPMTQAYYDQSBV-JHVJFLLYSA-N
Mol Weight 362.9 g/mol
Molecular Formula C21H27ClO3
Exact Mass 362.164872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnN0WFcac6o
Name (4aS,6aS,12bS)-11-chloranyl-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6-hexahydrobenzo[a]xanthene-9,10-diol
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Formula C21H27ClO3
InChI InChI=1S/C21H27ClO3/c1-19(2)7-5-8-20(3)15(19)6-9-21(4)16(20)10-12-14(25-21)11-13(23)18(24)17(12)22/h10-11,15,23-24H,5-9H2,1-4H3/t15-,20-,21-/m0/s1
InChIKey OQPMTQAYYDQSBV-JHVJFLLYSA-N
Molecular Weight 362.897 g/mol
SMILES Oc1cc2O[C@]3(CC[C@@]4([C@@](C3=Cc2c(c1O)Cl)(CCCC4(C)C)C)[H])C
SPLASH splash10-0002-0009000000-4fbde184433a35513c61
Source of Spectrum J-60-7292-8
Synonyms (4aS,6aS,12bS)-11-chloro-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6-hexahydrobenzo[a]xanthene-9,10-diol
Wiley ID 1349695