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4-Methyl-bicyclo(2.2.2)oct-2-en-1-carboxylic acid, ethyl ester

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4-Methyl-bicyclo(2.2.2)oct-2-en-1-carboxylic acid, ethyl ester
SpectraBase Compound ID 5TOVuCRF24I
InChI InChI=1S/C12H18O2/c1-3-14-10(13)12-7-4-11(2,5-8-12)6-9-12/h4,7H,3,5-6,8-9H2,1-2H3
InChIKey KJSSUEWQJSHUNE-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNFO6iaXZmt
Name 4-Methyl-bicyclo(2.2.2)oct-2-en-1-carboxylic acid, ethyl ester
CAS Registry Number 5549-04-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-3-14-10(13)12-7-4-11(2,5-8-12)6-9-12/h4,7H,3,5-6,8-9H2,1-2H3
InChIKey KJSSUEWQJSHUNE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference S. Berger, Org. Magn. Resonance 14, 65 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3