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3Aa-methyl-2-oxo-2,3,3aa, 4,5,6,7,7ab-octahydro-1H-indene-1-carboxylic acid, methyl ester
SpectraBase Compound ID BA3f0PG3kgM
InChI InChI=1S/C12H18O3/c1-12-6-4-3-5-8(12)10(9(13)7-12)11(14)15-2/h8,10H,3-7H2,1-2H3
InChIKey YGCRDBRUTTXIQD-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 DvoYS0WHf5y
Name 3Aa-methyl-2-oxo-2,3,3aa, 4,5,6,7,7ab-octahydro-1H-indene-1-carboxylic acid, methyl ester
CAS Registry Number 104712-99-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-12-6-4-3-5-8(12)10(9(13)7-12)11(14)15-2/h8,10H,3-7H2,1-2H3
InChIKey YGCRDBRUTTXIQD-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