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(1R,1'R-Rs)-1-[1-Chloro-1-(p-tolylsulfinyl)methyl]-2-cyclohexen-1-ol
SpectraBase Compound ID JHQlgo7FUgW
InChI InChI=1S/C14H17ClO2S/c1-11-5-7-12(8-6-11)18(17)13(15)14(16)9-3-2-4-10-14/h3,5-9,13,16H,2,4,10H2,1H3/t13-,14-,18?/m0/s1
InChIKey AIBZCBBSFBSBPU-QPKCZYJBSA-N
Mol Weight 284.8 g/mol
Molecular Formula C14H17ClO2S
Exact Mass 284.063779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKWmGhPIXDx
Name (1R,1'R-Rs)-1-[1-Chloro-1-(p-tolylsulfinyl)methyl]-2-cyclohexen-1-ol
Alternate Name(s) (1R)-1-{(R)-chloro[(4-methylphenyl)sulfinyl]methyl}-2-cyclohexen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClO2S
InChI InChI=1S/C14H17ClO2S/c1-11-5-7-12(8-6-11)18(17)13(15)14(16)9-3-2-4-10-14/h3,5-9,13,16H,2,4,10H2,1H3/t13-,14-,18?/m0/s1
InChIKey AIBZCBBSFBSBPU-QPKCZYJBSA-N
Molecular Weight 284.801 g/mol
SMILES O[C@@]1([C@]([S@@](c2ccc(cc2)C)=O)(Cl)[H])C=CCCC1
SPLASH splash10-0006-0900000000-d8ae2d9464b744092651
Source of Spectrum AJ-65-2972-0
Wiley ID 771762