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3-Hydroxymethyl-6,7-dimethoxy-1-(3,4-methylenedioxy-phenyl)-1,2,3,4-tetrahydro-2-naphthoic acid, .gamma.-lactone
SpectraBase Compound ID En55K5cHUbL
InChI InChI=1S/C21H20O6/c1-23-16-7-12-5-13-9-25-21(22)20(13)19(14(12)8-17(16)24-2)11-3-4-15-18(6-11)27-10-26-15/h3-4,6-8,13,19-20H,5,9-10H2,1-2H3
InChIKey LAFREGHROJJWDK-UHFFFAOYSA-N
Mol Weight 368.39 g/mol
Molecular Formula C21H20O6
Exact Mass 368.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CrOKMBuLQuA
Name 3-Hydroxymethyl-6,7-dimethoxy-1-(3,4-methylenedioxy-phenyl)-1,2,3,4-tetrahydro-2-naphthoic acid, .gamma.-lactone
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H20O6
InChI InChI=1S/C21H20O6/c1-23-16-7-12-5-13-9-25-21(22)20(13)19(14(12)8-17(16)24-2)11-3-4-15-18(6-11)27-10-26-15/h3-4,6-8,13,19-20H,5,9-10H2,1-2H3
InChIKey LAFREGHROJJWDK-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference A. Pelter, R.S. Ward, M.C. Pritchard, J. Chem. Soc. Perkin I 1603 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3