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1,3-Dimethyl-3-hydroxy-bicyclo(2.2.2)oct-5-en-2-one-8-carboxylic acid, lactone
SpectraBase Compound ID 4puSvm6sjgo
InChI InChI=1S/C11H12O3/c1-10-4-3-7-6(5-10)8(12)14-11(7,2)9(10)13/h3-4,6-7H,5H2,1-2H3/t6-,7+,10-,11-/m1/s1
InChIKey CZAKTVRUFHQWRG-LRMGWDNHSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9XL01gblK6m
Name 1,3-Dimethyl-3-hydroxy-bicyclo(2.2.2)oct-5-en-2-one-8-carboxylic acid, lactone
CAS Registry Number 71998-56-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-10-4-3-7-6(5-10)8(12)14-11(7,2)9(10)13/h3-4,6-7H,5H2,1-2H3/t6-,7+,10-,11-/m1/s1
InChIKey CZAKTVRUFHQWRG-LRMGWDNHSA-N
Instrument Name Varian CFT-20
Literature Reference G.E. Langford, H. Auksi, J.A. Gosbee, Tetrahedron 37, 1091 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3