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(1RS,2RS,3RS,6RS)-3,6-Di(phenylthio)cyclohex-4-en-1,2-diol
SpectraBase Compound ID 8vN7RkVypV8
InChI InChI=1S/C18H18O2S2/c19-17-15(21-13-7-3-1-4-8-13)11-12-16(18(17)20)22-14-9-5-2-6-10-14/h1-12,15-20H/t15-,16-,17-,18+/m0/s1
InChIKey XBKIKYPMXZRNEB-XLAORIBOSA-N
Mol Weight 330.46 g/mol
Molecular Formula C18H18O2S2
Exact Mass 330.074822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxfZuHfwt0W
Name (1RS,2RS,3RS,6RS)-3,6-Di(phenylthio)cyclohex-4-en-1,2-diol
Alternate Name(s) 3,6-bis(phenylsulfanyl)-4-cyclohexene-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O2S2
InChI InChI=1S/C18H18O2S2/c19-17-15(21-13-7-3-1-4-8-13)11-12-16(18(17)20)22-14-9-5-2-6-10-14/h1-12,15-20H/t15-,16-,17-,18+/m0/s1
InChIKey XBKIKYPMXZRNEB-XLAORIBOSA-N
Molecular Weight 330.460 g/mol
SMILES O[C@]1([C@]([C@](C=C[C@@]1(Sc1ccccc1)[H])(Sc1ccccc1)[H])(O)[H])[H]
SPLASH splash10-0230-9570000000-a90c79ab16f13b120850
Source of Spectrum F-50-3715-9
Wiley ID 1327756