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1-Methyl-2-[(phenylthio)methylidene]cyclohexane-1-ol
SpectraBase Compound ID Y8cOjJXndm
InChI InChI=1S/C14H18OS/c1-14(15)10-6-5-7-12(14)11-16-13-8-3-2-4-9-13/h2-4,8-9,11,15H,5-7,10H2,1H3/b12-11+
InChIKey OAWNBRHGKTULJB-VAWYXSNFSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJ81FnYS1oi
Name 1-Methyl-2-[(phenylthio)methylidene]cyclohexane-1-ol
Alternate Name(s) (2E)-1-methyl-2-[(phenylsulfanyl)methylene]cyclohexanol
CAS Registry Number 119044-31-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-14(15)10-6-5-7-12(14)11-16-13-8-3-2-4-9-13/h2-4,8-9,11,15H,5-7,10H2,1H3/b12-11+
InChIKey OAWNBRHGKTULJB-VAWYXSNFSA-N
Molecular Weight 234.357 g/mol
SMILES OC1(\C(=C\Sc2ccccc2)CCCC1)C
SPLASH splash10-004l-5920000000-7e7a3fd4077ac9d02dff
Source of Spectrum F-44-4467-0
Wiley ID 1236054