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(3Aa, 7aa)-7b-methoxy-1,2,3,6,7,7a-hexahydro-3ah-inden-6-one-carboxylic acid, methyl ester
SpectraBase Compound ID F0hnbMIEu1
InChI InChI=1S/C12H16O4/c1-15-10-8-4-3-6-12(8,11(14)16-2)7-5-9(10)13/h5,7-8,10H,3-4,6H2,1-2H3
InChIKey IFYLIHLTEAWGGG-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LSxzmBSMqXs
Name (3Aa, 7aa)-7b-methoxy-1,2,3,6,7,7a-hexahydro-3ah-inden-6-one-carboxylic acid, methyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-15-10-8-4-3-6-12(8,11(14)16-2)7-5-9(10)13/h5,7-8,10H,3-4,6H2,1-2H3
InChIKey IFYLIHLTEAWGGG-UHFFFAOYSA-N
Instrument Name Jeol FX-200
Literature Reference A.L. Beckwith, D.H. Roberts, J. Am. Chem. Soc. 108, 5893 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3