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(10S,11S)-7,12-dimethyl-10,11-dihydrobenzo[a]anthracene-10,11-diol
SpectraBase Compound ID DoXOWOo3dnL
InChI InChI=1S/C20H18O2/c1-11-14-8-7-13-5-3-4-6-16(13)18(14)12(2)19-15(11)9-10-17(21)20(19)22/h3-10,17,20-22H,1-2H3/t17-,20+/m0/s1
InChIKey PKGSJEQYYURMAR-FXAWDEMLSA-N
Mol Weight 290.36 g/mol
Molecular Formula C20H18O2
Exact Mass 290.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LNeqfJsaaP
Name (10S,11S)-7,12-dimethyl-10,11-dihydrobenzo[a]anthracene-10,11-diol
CAS Registry Number 72471-79-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O2
InChI InChI=1S/C20H18O2/c1-11-14-8-7-13-5-3-4-6-16(13)18(14)12(2)19-15(11)9-10-17(21)20(19)22/h3-10,17,20-22H,1-2H3/t17-,20+/m0/s1
InChIKey PKGSJEQYYURMAR-FXAWDEMLSA-N
Molecular Weight 290.362 g/mol
SMILES O[C@]1(c2c(C=C[C@@]1(O)[H])c(c1c(c2C)c2c(cc1)cccc2)C)[H]
SPLASH splash10-0f96-0090000000-919e2b8453330a5bd36f
Source of Spectrum W5-1989-8386-1
Synonyms (10S,11S)-7,12-dimethyl-10,11-dihydrobenz[a]anthracene-10,11-diol 7,12-Dimethylbenz(a)anthracene-10,11-dihydrodiol 7,12-Dimethylbenz(a)anthracene-trans-10,11-dihydrodiol trans-10,11-dihydro-7,12-dimethylbenz(a)anthracene-10,11-diol
Wiley ID 1294098