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Bicyclo[3.1.0]hexane-1-carboxylic acid, 3-(2-methylpropyl)-2-oxo-, methyl ester
SpectraBase Compound ID HNAZ7ZpfRKN
InChI InChI=1S/C12H18O3/c1-7(2)4-8-5-9-6-12(9,10(8)13)11(14)15-3/h7-9H,4-6H2,1-3H3
InChIKey COMLZONNKKEXTI-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWQZTbRMMJN
Name 3-(2-Methyl-propyl)-2-oxo-bicyclo(3.1.0)hexane-1-carboxylic acid, methylester
CAS Registry Number 104620-27-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7(2)4-8-5-9-6-12(9,10(8)13)11(14)15-3/h7-9H,4-6H2,1-3H3
InChIKey COMLZONNKKEXTI-UHFFFAOYSA-N
Literature Reference D.F. Taber, R.E. Ruckle, J. Am. Chem. Soc. 108, 7686 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported