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(10S,11S)-12-methyl-7-methylol-10,11-dihydrobenz[a]anthracene-10,11-diol
SpectraBase Compound ID 4Rqc6Z40xn9
InChI InChI=1S/C20H18O3/c1-11-18-13-5-3-2-4-12(13)6-7-14(18)16(10-21)15-8-9-17(22)20(23)19(11)15/h2-9,17,20-23H,10H2,1H3/t17-,20+/m0/s1
InChIKey INTDLXHJDDGCMY-FXAWDEMLSA-N
Mol Weight 306.36 g/mol
Molecular Formula C20H18O3
Exact Mass 306.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ezvA91to0
Name (10S,11S)-12-methyl-7-methylol-10,11-dihydrobenz[a]anthracene-10,11-diol
Alternate Name(s) (10S,11S)-7-(hydroxymethyl)-12-methyl-10,11-dihydrobenzo[a]anthracene-10,11-diol Benz(a)anthracene-10,11-diol, 10,11-dihydro-7-(hydroxymethyl)-12-methyl-, trans- trans-10,11-dihydro-7-(hydroxymethyl)-12-methylbenz(a)anthracene-10,11-diol trans-7-hydroxymethyl-12-methylbenz(a)anthracene-10,11-dihydrodiol
CAS Registry Number 71722-00-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O3
InChI InChI=1S/C20H18O3/c1-11-18-13-5-3-2-4-12(13)6-7-14(18)16(10-21)15-8-9-17(22)20(23)19(11)15/h2-9,17,20-23H,10H2,1H3/t17-,20+/m0/s1
InChIKey INTDLXHJDDGCMY-FXAWDEMLSA-N
Molecular Weight 306.361 g/mol
SMILES OCc1c2c([C@@]([C@](C=C2)(O)[H])(O)[H])c(c2c1ccc1c2cccc1)C
SPLASH splash10-0pxr-0091000000-1f77511d781e266444af
Source of Spectrum W5-1989-8374-1
Wiley ID 1308462