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

*Links on SpectraBase are not permalinks.
3,3-Diethyl-4,4-diethyl-1-((4-methylphenyl)sulfonyl)-5-hexen-2-one
SpectraBase Compound ID 6WBYAPIN52S
InChI InChI=1S/C21H32O3S/c1-7-20(8-2,9-3)21(10-4,11-5)19(22)16-25(23,24)18-14-12-17(6)13-15-18/h7,12-15H,1,8-11,16H2,2-6H3
InChIKey XSTZGOMMKJJHKA-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O3S
Exact Mass 364.207216 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 GSymAa2Txs7
Name 3,3-Diethyl-4,4-diethyl-1-((4-methylphenyl)sulfonyl)-5-hexen-2-one
CAS Registry Number 123209-36-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O3S
InChI InChI=1S/C21H32O3S/c1-7-20(8-2,9-3)21(10-4,11-5)19(22)16-25(23,24)18-14-12-17(6)13-15-18/h7,12-15H,1,8-11,16H2,2-6H3
InChIKey XSTZGOMMKJJHKA-UHFFFAOYSA-N
Molecular Weight 364.544 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(C(C(C=C)(CC)CC)(CC)CC)=O
SPLASH splash10-0a4l-9100000000-3a8668c2e0ec27232f54
Source of Spectrum C-111-8889-3
Synonyms 3,3,4,4-tetraethyl-1-[(4-methylphenyl)sulfonyl]-5-hexen-2-one
Wiley ID 1350877