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(E)-2-(2-Oxocycloheptyl)methyl-1-propenyl phenyl sulfone
SpectraBase Compound ID JfKt1cwlvyr
InChI InChI=1S/C17H22O3S/c1-14(12-15-8-4-2-7-11-17(15)18)13-21(19,20)16-9-5-3-6-10-16/h3,5-6,9-10,13,15H,2,4,7-8,11-12H2,1H3/b14-13+
InChIKey WOBYLGKYFOXBIT-BUHFOSPRSA-N
Mol Weight 306.42 g/mol
Molecular Formula C17H22O3S
Exact Mass 306.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5KebLinXar
Name (E)-2-(2-Oxocycloheptyl)methyl-1-propenyl phenyl sulfone
Alternate Name(s) 2-{2-[(1E)-1-propenylsulfonyl]benzyl}cycloheptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3S
InChI InChI=1S/C17H22O3S/c1-14(12-15-8-4-2-7-11-17(15)18)13-21(19,20)16-9-5-3-6-10-16/h3,5-6,9-10,13,15H,2,4,7-8,11-12H2,1H3/b14-13+
InChIKey WOBYLGKYFOXBIT-BUHFOSPRSA-N
Molecular Weight 306.420 g/mol
SMILES C(\C(=C\S(=O)(=O)c1ccccc1)C)C1C(=O)CCCCC1
SPLASH splash10-014i-1900000000-1b6538a9a32e056cfe21
Source of Spectrum C-115-12339-15
Wiley ID 1308047