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

*Links on SpectraBase are not permalinks.
Cyclohexaneacetic acid, 2-methylene-.alpha.-(methylsulfonyl)-, methyl ester
SpectraBase Compound ID EJExQggnxhv
InChI InChI=1S/C11H18O4S/c1-15-11(12)10(16(2,13)14)8-9-6-4-3-5-7-9/h6,10H,3-5,7-8H2,1-2H3
InChIKey KYWQGIODCPVOEK-UHFFFAOYSA-N
Mol Weight 246.32 g/mol
Molecular Formula C11H18O4S
Exact Mass 246.09258 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 JqgpQtPDmQ7
Name Cyclohexaneacetic acid, 2-methylene-.alpha.-(methylsulfonyl)-, methyl ester
CAS Registry Number 67428-15-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4S
InChI InChI=1S/C11H18O4S/c1-15-11(12)10(16(2,13)14)8-9-6-4-3-5-7-9/h6,10H,3-5,7-8H2,1-2H3
InChIKey KYWQGIODCPVOEK-UHFFFAOYSA-N
Molecular Weight 246.321 g/mol
SMILES C(S(=O)(=O)C)(C(=O)OC)CC1=CCCCC1
SPLASH splash10-014i-4900000000-6692965719c8a805c82b
Source of Spectrum C-100-3422-0
Synonyms 1-(2'-Carbomethoxy-2'-methylsulfonylethyl)cyclohexene Methyl 3-(1-cyclohexen-1-yl)-2-(methylsulfonyl)propanoate
Wiley ID 1248540