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2-Phenylsulfonyl-4-tert-butylcyclohexanone
SpectraBase Compound ID 4yAbQR62z0C
InChI InChI=1S/C16H22O3S/c1-16(2,3)12-9-10-14(17)15(11-12)20(18,19)13-7-5-4-6-8-13/h4-8,12,15H,9-11H2,1-3H3
InChIKey FHJGOKCGOXHZAP-UHFFFAOYSA-N
Mol Weight 294.41 g/mol
Molecular Formula C16H22O3S
Exact Mass 294.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sjZXRPU977
Name 2-Phenylsulfonyl-4-tert-butylcyclohexanone
Alternate Name(s) 4-tert-Butyl-2-(phenylsulfonyl)cyclohexanone 2-(benzenesulfonyl)-4-tert-butyl-1-cyclohexanone 2-(benzenesulfonyl)-4-tert-butylcyclohexan-1-one 2-(benzenesulfonyl)-4-tert-butyl-cyclohexanone 4-tert-Butyl-2-(phenylsulfonyl)cyclohexan-1-one
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Formula C16H22O3S
InChI InChI=1S/C16H22O3S/c1-16(2,3)12-9-10-14(17)15(11-12)20(18,19)13-7-5-4-6-8-13/h4-8,12,15H,9-11H2,1-3H3
InChIKey FHJGOKCGOXHZAP-UHFFFAOYSA-N
Molecular Weight 294.409 g/mol
SMILES C1(C(CC(CC1)C(C)(C)C)S(=O)(=O)c1ccccc1)=O
SPLASH splash10-0udi-0950000000-3e10e8b025ee661e3922
Source of Spectrum QE-8-936-7
Wiley ID 1557261