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2,4-Dimethyl-3-methylidene-4-oxidanyl-2-(phenylsulfanylmethyl)cyclohexan-1-one
SpectraBase Compound ID 9ZyRXe46SLc
InChI InChI=1S/C16H20O2S/c1-12-15(2,14(17)9-10-16(12,3)18)11-19-13-7-5-4-6-8-13/h4-8,18H,1,9-11H2,2-3H3
InChIKey WEPACAMMXVLZSZ-UHFFFAOYSA-N
Mol Weight 276.39 g/mol
Molecular Formula C16H20O2S
Exact Mass 276.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84ih3QSMPNY
Name 2,4-Dimethyl-3-methylidene-4-oxidanyl-2-(phenylsulfanylmethyl)cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2S
InChI InChI=1S/C16H20O2S/c1-12-15(2,14(17)9-10-16(12,3)18)11-19-13-7-5-4-6-8-13/h4-8,18H,1,9-11H2,2-3H3
InChIKey WEPACAMMXVLZSZ-UHFFFAOYSA-N
Molecular Weight 276.394 g/mol
SMILES OC1(C(C(C(CC1)=O)(CSc1ccccc1)C)=C)C
SPLASH splash10-05fr-0910000000-0ea21da1b2bf2d935deb
Source of Spectrum D1-1993-932-5
Synonyms 4-Hydroxy-2,4-dimethyl-3-methylene-2-[(phenylthio)methyl]-1-cyclohexanone 4-Hydroxy-2,4-dimethyl-3-methylene-2-[(phenylthio)methyl]cyclohexanone 4-Hydroxy-2,4-dimethyl-3-methylidene-2-(phenylsulfanylmethyl)cyclohexan-1-one
Wiley ID 834474