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2-Oxo-2,3,3aa, 4,5,6,7,7ab-octahydro-1H-indene-1-carboxylic acid, methyl ester

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2-Oxo-2,3,3aa, 4,5,6,7,7ab-octahydro-1H-indene-1-carboxylic acid, methyl ester
SpectraBase Compound ID JGf4zy5wTYQ
InChI InChI=1S/C11H16O3/c1-14-11(13)10-8-5-3-2-4-7(8)6-9(10)12/h7-8,10H,2-6H2,1H3
InChIKey IPTBOELSAGVARS-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKF5rZzmSE4
Name 2-Oxo-2,3,3aa, 4,5,6,7,7ab-octahydro-1H-indene-1-carboxylic acid, methyl ester
CAS Registry Number 104620-48-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-14-11(13)10-8-5-3-2-4-7(8)6-9(10)12/h7-8,10H,2-6H2,1H3
InChIKey IPTBOELSAGVARS-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