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

*Links on SpectraBase are not permalinks.

1-METHYL-4-OXO-2,5-CYCLOHEXADIEN-1-CARBONSAEUREETHYLESTER

View entire compound with spectra: 6 NMR

1-METHYL-4-OXO-2,5-CYCLOHEXADIEN-1-CARBONSAEUREETHYLESTER
SpectraBase Compound ID JEZBfuz3Mlc
InChI InChI=1S/C10H12O3/c1-3-13-9(12)10(2)6-4-8(11)5-7-10/h4-7H,3H2,1-2H3
InChIKey IIMMQDLVQXHQBC-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 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 1vpAW0joq1W
Name 1-Methyl-4-oxo-2,5-cyclohexadiene-1-carboxylic acid, ethyl ester
CAS Registry Number 52008-71-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-3-13-9(12)10(2)6-4-8(11)5-7-10/h4-7H,3H2,1-2H3
InChIKey IIMMQDLVQXHQBC-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference W. Gramlich, Liebigs Ann. Chem. 121 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3