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2-Phenylsulfonyl-4-methylcyclohexanone

View entire compound with spectra: 1 MS (GC)

2-Phenylsulfonyl-4-methylcyclohexanone
SpectraBase Compound ID CpGB5lGnYEs
InChI InChI=1S/C13H16O3S/c1-10-7-8-12(14)13(9-10)17(15,16)11-5-3-2-4-6-11/h2-6,10,13H,7-9H2,1H3
InChIKey OXTFBOABUNHEME-UHFFFAOYSA-N
Mol Weight 252.33 g/mol
Molecular Formula C13H16O3S
Exact Mass 252.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wm9shw0xmV
Name 2-Phenylsulfonyl-4-methylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3S
InChI InChI=1S/C13H16O3S/c1-10-7-8-12(14)13(9-10)17(15,16)11-5-3-2-4-6-11/h2-6,10,13H,7-9H2,1H3
InChIKey OXTFBOABUNHEME-UHFFFAOYSA-N
Molecular Weight 252.328 g/mol
SMILES C1(C(CC(CC1)C)S(=O)(=O)c1ccccc1)=O
SPLASH splash10-0a4r-0900000000-7627ccdfd60b3b58068d
Source of Spectrum QE-8-936-7
Synonyms 4-Methyl-2-(phenylsulfonyl)cyclohexanone
Wiley ID 1557260