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.alpha.-(4-Methyl-cyclohex-1-en-1yl)-(2-hydroxy-benzene)-acetic acid, methyl ester diastereomer 1
SpectraBase Compound ID 82zSfSPh6qA
InChI InChI=1S/C16H20O3/c1-11-7-9-12(10-8-11)15(16(18)19-2)13-5-3-4-6-14(13)17/h3-6,9,11,15,17H,7-8,10H2,1-2H3
InChIKey ZEZKQVZHPVUTIZ-UHFFFAOYSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bsgp0Aab48N
Name .alpha.-(4-Methyl-cyclohex-1-en-1yl)-(2-hydroxy-benzene)-acetic acid, methyl ester diastereomer 2
CAS Registry Number 89908-57-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-11-7-9-12(10-8-11)15(16(18)19-2)13-5-3-4-6-14(13)17/h3-6,9,11,15,17H,7-8,10H2,1-2H3
InChIKey ZEZKQVZHPVUTIZ-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference A.G. Schultz, J.J. Napier, P. Sundararam, J. Am. Chem. Soc. 106, 3590 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3