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A-Phenyl-2-oxo-cyclohexanepropanoic acid, methyl ester

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A-Phenyl-2-oxo-cyclohexanepropanoic acid, methyl ester
SpectraBase Compound ID 8hfy44rCiZ5
InChI InChI=1S/C16H20O3/c1-19-16(18)14(12-7-3-2-4-8-12)11-13-9-5-6-10-15(13)17/h2-4,7-8,13-14H,5-6,9-11H2,1H3
InChIKey WJEMKQHTGYSLIL-UHFFFAOYSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3IvosyCELhA
Name A-Phenyl-2-oxo-cyclohexanepropanoic acid, methyl ester
CAS Registry Number 74090-37-2
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-19-16(18)14(12-7-3-2-4-8-12)11-13-9-5-6-10-15(13)17/h2-4,7-8,13-14H,5-6,9-11H2,1H3
InChIKey WJEMKQHTGYSLIL-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