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Benz[a]anthracene, 5,6,6a,7,12,12a-hexahydro-4-methoxy-1-methyl-, cis-
SpectraBase Compound ID DItkHTSu9qC
InChI InChI=1S/C20H22O/c1-13-7-10-19(21-2)17-9-8-16-11-14-5-3-4-6-15(14)12-18(16)20(13)17/h3-7,10,16,18H,8-9,11-12H2,1-2H3/t16-,18+/m0/s1
InChIKey PRXHHCKRTMIHTN-FUHWJXTLSA-N
Mol Weight 278.39 g/mol
Molecular Formula C20H22O
Exact Mass 278.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOLTczpxFpC
Name Benz[a]anthracene, 5,6,6a,7,12,12a-hexahydro-4-methoxy-1-methyl-, cis-
Alternate Name(s) (6aS,12aR)-1-methyl-5,6,6a,7,12,12a-hexahydrobenzo[a]anthracen-4-yl methyl ether (6aS,12aR)-4-methoxy-1-methyl-5,6,6a,7,12,12a-hexahydrobenzo[a]anthracene 1-Methyl-4-methyl-4-methoxy-5,6,6a,7,12,12a-hexahydrobenzo(a)anthracene
CAS Registry Number 91790-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O
InChI InChI=1S/C20H22O/c1-13-7-10-19(21-2)17-9-8-16-11-14-5-3-4-6-15(14)12-18(16)20(13)17/h3-7,10,16,18H,8-9,11-12H2,1-2H3/t16-,18+/m0/s1
InChIKey PRXHHCKRTMIHTN-FUHWJXTLSA-N
Molecular Weight 278.395 g/mol
SMILES [C@@]12(c3c(c(OC)ccc3C)CC[C@]1(Cc1ccccc1C2)[H])[H]
SPLASH splash10-00fr-0960000000-267752f246617e8a2a23
Source of Spectrum O-19-156-5
Wiley ID 1282613