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2-HYDROXY-4-OXO-2-CHROMANCARBOXYLIC ACID, ETHYL ESTER
SpectraBase Compound ID 2RpbYTpisR2
InChI InChI=1S/C12H12O5/c1-2-16-11(14)12(15)7-9(13)8-5-3-4-6-10(8)17-12/h3-6,15H,2,7H2,1H3
InChIKey VLNKCVLJRGHWNJ-UHFFFAOYSA-N
Mol Weight 236.22 g/mol
Molecular Formula C12H12O5
Exact Mass 236.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QgbnoPPdIN
Name 2-Hydroxy-4-oxo-chroman-2-carboxylic acid, ethyl ester
CAS Registry Number 65950-31-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12O5
InChI InChI=1S/C12H12O5/c1-2-16-11(14)12(15)7-9(13)8-5-3-4-6-10(8)17-12/h3-6,15H,2,7H2,1H3
InChIKey VLNKCVLJRGHWNJ-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