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1-Methyl-3-[(phenylthio)methylene]-1-cyclohexene
SpectraBase Compound ID 1tMN4U7KkcB
InChI InChI=1S/C14H16S/c1-12-6-5-7-13(10-12)11-15-14-8-3-2-4-9-14/h2-4,8-11H,5-7H2,1H3/b13-11+
InChIKey OWVYSOJVKDFCMO-ACCUITESSA-N
Mol Weight 216.34 g/mol
Molecular Formula C14H16S
Exact Mass 216.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9f8TrscAQ7K
Name 1-Methyl-3-[(phenylthio)methylene]-1-cyclohexene
Alternate Name(s) (E)-(3-methyl-2-cyclohexen-1-ylidene)methyl phenyl sulfide {[(E)-(3-methyl-2-cyclohexen-1-ylidene)methyl]sulfanyl}benzene
CAS Registry Number 104115-19-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16S
InChI InChI=1S/C14H16S/c1-12-6-5-7-13(10-12)11-15-14-8-3-2-4-9-14/h2-4,8-11H,5-7H2,1H3/b13-11+
InChIKey OWVYSOJVKDFCMO-ACCUITESSA-N
Molecular Weight 216.342 g/mol
SMILES C=1\C(=C\Sc2ccccc2)CCCC1C
SPLASH splash10-0a6u-5920000000-86253ac9714f79dcf7a9
Source of Spectrum J-51-3991-20
Wiley ID 1215953