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A-Methyl-2-oxo-cyclohexanepropanoic acid, methyl ester
SpectraBase Compound ID 3lmSMV6aTQc
InChI InChI=1S/C11H18O3/c1-8(11(13)14-2)7-9-5-3-4-6-10(9)12/h8-9H,3-7H2,1-2H3
InChIKey OTPHUJJJZNBFAV-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G8TewiqRg5
Name A-Methyl-2-oxo-cyclohexanepropanoic acid, methyl ester
CAS Registry Number 63714-94-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-8(11(13)14-2)7-9-5-3-4-6-10(9)12/h8-9H,3-7H2,1-2H3
InChIKey OTPHUJJJZNBFAV-UHFFFAOYSA-N
Literature Reference L.S. Hegedus, W.H. Darlington, J. Am. Chem. Soc. 102, 4980 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3