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5-Methyl-3-(2-methyl-1-propyl)-2-oxo-cyclopentanecarboxylic acid, methylester

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5-Methyl-3-(2-methyl-1-propyl)-2-oxo-cyclopentanecarboxylic acid, methylester
SpectraBase Compound ID EYjOYxl9Y34
InChI InChI=1S/C12H20O3/c1-7(2)5-9-6-8(3)10(11(9)13)12(14)15-4/h7-10H,5-6H2,1-4H3
InChIKey LZQXOGHTMPVSPA-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eEu4Zb9Gmj
Name 5-Methyl-3-(2-methyl-1-propyl)-2-oxo-cyclopentanecarboxylic acid, methylester
CAS Registry Number 104620-10-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-7(2)5-9-6-8(3)10(11(9)13)12(14)15-4/h7-10H,5-6H2,1-4H3
InChIKey LZQXOGHTMPVSPA-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