For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(Phenylsulfonyl)-5-hexen-2-one
SpectraBase Compound ID 96kznSI9T7o
InChI InChI=1S/C12H14O3S/c1-2-3-7-11(13)10-16(14,15)12-8-5-4-6-9-12/h2,4-6,8-9H,1,3,7,10H2
InChIKey WEFDPVTVZDRFGC-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID F5dRkLjVuKk
Name 1-(Phenylsulfonyl)-5-hexen-2-one
CAS Registry Number 80945-31-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-2-3-7-11(13)10-16(14,15)12-8-5-4-6-9-12/h2,4-6,8-9H,1,3,7,10H2
InChIKey WEFDPVTVZDRFGC-UHFFFAOYSA-N
Molecular Weight 238.301 g/mol
SMILES C(S(=O)(=O)c1ccccc1)C(=O)CCC=C
SPLASH splash10-002e-9000000000-80caf5e2dda702cfc916
Source of Spectrum C-111-8888-3
Synonyms 1-(benzenesulfonyl)-5-hexen-2-one 1-(benzenesulfonyl)hex-5-en-2-one 1-(Phenylsulfonyl)hex-5-en-2-one 1-besylhex-5-en-2-one
Wiley ID 1240234