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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 22K1b1fkHnM
Name 2-HYDROXY-3-METHYL-4-OXO-2-CHROMANCARBOXYLIC ACID, ETHYL ESTER
Source of Sample W. Trowitzsch Liebigs Ann. Chem. 1977, 1707
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Molecular Weight 250.25
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian CFT-20
Synonyms 2-CHROMANCARBOXYLIC ACID, 2-HYDROXY-3-METHYL-4-OXO-, ETHYL ESTER