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2-(Phenylsulfanyl)cyclohexanone
SpectraBase Compound ID ANqDGTviyV0
InChI InChI=1S/C12H14OS/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-3,6-7,12H,4-5,8-9H2
InChIKey RKYGZMWFURXDKP-UHFFFAOYSA-N
Mol Weight 206.3 g/mol
Molecular Formula C12H14OS
Exact Mass 206.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KmyrDz5lra
Name 2-(Phenylsulfanyl)cyclohexanone
CAS Registry Number 110452-14-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14OS
InChI InChI=1S/C12H14OS/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-3,6-7,12H,4-5,8-9H2
InChIKey RKYGZMWFURXDKP-UHFFFAOYSA-N
Molecular Weight 206.303 g/mol
SMILES C1(Sc2ccccc2)C(=O)CCCC1
SPLASH splash10-08fr-5970000000-6c031c1001deaabb97e1
Source of Spectrum C-98-4898-0
Synonyms 2-(Phenylthio)-1-cyclohexanone 2-(Phenylthio)cyclohexanone 2-Phenylsulfanylcyclohexan-1-one
Wiley ID 1204309