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beta-METHOXY-beta-METHYLHYDROCINNAMIC ACID, METHYL ESTER

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beta-METHOXY-beta-METHYLHYDROCINNAMIC ACID, METHYL ESTER
SpectraBase Compound ID GgmIhsXpe8G
InChI InChI=1S/C12H16O3/c1-12(15-3,9-11(13)14-2)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKey VYTRRBSXJMSJAI-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4PnBWtXcvle
Name 3-Methoxy-3-phenyl-butyric acid, methyl ester
CAS Registry Number 58219-53-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-12(15-3,9-11(13)14-2)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKey VYTRRBSXJMSJAI-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference D.E. James, J.K. Stille, J. Org. Chem. 41, 1504 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3