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

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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

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SpectraBase Spectrum ID 1qV8zew98qU
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
Literature Reference Liebigs Ann. Chem. 121 (1978).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3