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2-Hydroxy-1,2-dimethyl-4-methylidene-cycloheptanecarboxylic acid, ethyl ester
SpectraBase Compound ID 9CDfw6BIKMt
InChI InChI=1S/C13H22O3/c1-5-16-11(14)12(3)8-6-7-10(2)9-13(12,4)15/h15H,2,5-9H2,1,3-4H3
InChIKey KCAPSDCWDIJBCK-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9pvTcmOkAnG
Name 2-Hydroxy-1,2-dimethyl-4-methylidene-cycloheptanecarboxylic acid, ethyl ester
CAS Registry Number 105665-78-9
Comments HIGH FIELD SHIFTS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-5-16-11(14)12(3)8-6-7-10(2)9-13(12,4)15/h15H,2,5-9H2,1,3-4H3
InChIKey KCAPSDCWDIJBCK-UHFFFAOYSA-N
Literature Reference G.A. Molander, J.B. Etter, P.W.Zinke, J. Am. Chem. Soc. 109, 453 (1987).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3