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

*Links on SpectraBase are not permalinks.
Methyl 3-methyl-2-(phenylsulfonyl)-4-pentenoate
SpectraBase Compound ID HOSvbgvGjYd
InChI InChI=1S/C13H16O4S/c1-4-10(2)12(13(14)17-3)18(15,16)11-8-6-5-7-9-11/h4-10,12H,1H2,2-3H3
InChIKey NYFMMZXQRRPREV-UHFFFAOYSA-N
Mol Weight 268.33 g/mol
Molecular Formula C13H16O4S
Exact Mass 268.07693 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 FmRr22UccPL
Name 4-PENTENOIC ACID, 3-METHYL-2-(PHENYLSULFONYL)-, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16O4S
InChI InChI=1S/C13H16O4S/c1-4-10(2)12(13(14)17-3)18(15,16)11-8-6-5-7-9-11/h4-10,12H,1H2,2-3H3
InChIKey NYFMMZXQRRPREV-UHFFFAOYSA-N
Molecular Weight 268.0765
SMILES C=CC(C(S(=O)(=O)c1ccccc1)C(OC)=O)C
SPLASH splash10-056r-9100000000-ecebf4b3b22809bf41b7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany