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

*Links on SpectraBase are not permalinks.
1-ETHYL-4-METHYL-(E)-2-(PARA-TOLUENESULFONYL)-ETHENE-1,2-DICARBOXYLATE;MAJOR-ISOMER
SpectraBase Compound ID DVVKDvxLHui
InChI InChI=1S/C14H16O6S/c1-4-20-14(16)12(9-13(15)19-3)21(17,18)11-7-5-10(2)6-8-11/h5-9H,4H2,1-3H3/b12-9+
InChIKey XKTRTLARJIUDIU-FMIVXFBMSA-N
Mol Weight 312.34 g/mol
Molecular Formula C14H16O6S
Exact Mass 312.066759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HHetwGuesWT
Name 1-ETHYL-4-METHYL-(E)-2-(PARA-TOLUENESULFONYL)-ETHENE-1,2-DICARBOXYLATE;MAJOR-ISOMER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O6S
InChI InChI=1S/C14H16O6S/c1-4-20-14(16)12(9-13(15)19-3)21(17,18)11-7-5-10(2)6-8-11/h5-9H,4H2,1-3H3/b12-9+
InChIKey XKTRTLARJIUDIU-FMIVXFBMSA-N
Literature Reference Author S.YAMAZAKI,Y.YANASE,E.TANIGAWA,S.YAMABE,H.TAMURA
Literature Reference Citation J.ORG.CHEM.,64,9521(1999)
Literature Reference DOI 10.1021/jo9911591
Molecular Weight 312.337 g/mol
Sample ID 59947
Solvent CDCl3