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cis-7,12-dihydroxy-7,12-dimethyl-benz(a)anthracene
SpectraBase Compound ID DXFvJk3AePG
InChI InChI=1S/C20H18O2/c1-19(21)15-9-5-6-10-16(15)20(2,22)18-14-8-4-3-7-13(14)11-12-17(18)19/h3-12,21-22H,1-2H3/t19-,20+/m0/s1
InChIKey GJODVXBHWDFIDL-VQTJNVASSA-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 8tgizyQfUZA
Name cis-7,12-dihydroxy-7,12-dimethyl-benz(a)anthracene
Alternate Name(s) (7S,12R)-7,12-dimethyl-7,12-dihydrotetraphene-7,12-diol (7S,12R)-7,12-dimethylbenzo[a]anthracene-7,12-diol
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Formula C20H18O2
InChI InChI=1S/C20H18O2/c1-19(21)15-9-5-6-10-16(15)20(2,22)18-14-8-4-3-7-13(14)11-12-17(18)19/h3-12,21-22H,1-2H3/t19-,20+/m0/s1
InChIKey GJODVXBHWDFIDL-VQTJNVASSA-N
Molecular Weight 290.362 g/mol
SMILES O[C@]1(c2c3c(ccc2[C@@](c2ccccc12)(C)O)cccc3)C
SPLASH splash10-01t9-0190000000-05f1458dc2f88b647591
Source of Spectrum JX-2015-6-12468
Wiley ID 1731272