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2-HYDROXY-3-METHYL-4-OXO-2-CHROMANCARBOXYLIC ACID, ETHYL ESTER
SpectraBase Compound ID 6OvXidxE71v
InChI InChI=1S/C13H14O5/c1-3-17-12(15)13(16)8(2)11(14)9-6-4-5-7-10(9)18-13/h4-8,16H,3H2,1-2H3
InChIKey CKCTZIPLWHMHRX-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID zcPphhfMwc
Name 2-Hydroxy-3-methyl-4-oxo-chroman-2-carboxylic acid, ethyl ester
CAS Registry Number 85258-71-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-3-17-12(15)13(16)8(2)11(14)9-6-4-5-7-10(9)18-13/h4-8,16H,3H2,1-2H3
InChIKey CKCTZIPLWHMHRX-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference W. Trowitzsch, Liebigs Ann. Chem. 1707 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3