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(4aR,9S,9aS,10R)-9,10-Epithio-1.alpha.,4.alpha.-dimethoxy-(hexahydro)anthracene-S-oxide
SpectraBase Compound ID Hs1vGZvdriY
InChI InChI=1S/C16H18O3S/c1-18-11-7-8-12(19-2)14-13(11)15-9-5-3-4-6-10(9)16(14)20(15)17/h3-8,11-16H,1-2H3/t11-,12+,13-,14+,15-,16+,20?
InChIKey BKUPJVKTFSAAAJ-XPDHRFEZSA-N
Mol Weight 290.38 g/mol
Molecular Formula C16H18O3S
Exact Mass 290.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgSVyzQmlSz
Name (4aR,9S,9aS,10R)-9,10-Epithio-1.alpha.,4.alpha.-dimethoxy-(hexahydro)anthracene-S-oxide
Alternate Name(s) (1R,8S,9S,10R,13S,14R)-10,13-dimethoxy-15-thiatetracyclo[6.6.1.0(2,7).0(9,14)]pentadeca-2,4,6,11-tetraene 15-oxide 9,10-Epithio-1.alpha.,4.alpha.-dimethoxy-(hexahydro)anthracene-S-oxide
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Formula C16H18O3S
InChI InChI=1S/C16H18O3S/c1-18-11-7-8-12(19-2)14-13(11)15-9-5-3-4-6-10(9)16(14)20(15)17/h3-8,11-16H,1-2H3/t11-,12+,13-,14+,15-,16+,20?
InChIKey BKUPJVKTFSAAAJ-XPDHRFEZSA-N
Molecular Weight 290.377 g/mol
SMILES [C@]12([S@]([C@]([C@]3([C@](C=C[C@]([C@@]23[H])(OC)[H])(OC)[H])[H])(c2ccccc12)[H])=O)[H]
SPLASH splash10-03di-2910000000-105e19f69e08f498d211
Source of Spectrum D8-323-947-2
Wiley ID 1513881