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4H-1-Benzopyran-2-carboxylic acid, 6-bromo-4-oxo-, ethyl ester

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4H-1-Benzopyran-2-carboxylic acid, 6-bromo-4-oxo-, ethyl ester
SpectraBase Compound ID 5iO0DoR2ztL
InChI InChI=1S/C12H9BrO4/c1-2-16-12(15)11-6-9(14)8-5-7(13)3-4-10(8)17-11/h3-6H,2H2,1H3
InChIKey BDESGNKGTJQLCI-UHFFFAOYSA-N
Mol Weight 297.1 g/mol
Molecular Formula C12H9BrO4
Exact Mass 295.968422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxDrTbsTn83
Name 2-Ethoxycarbonyl-6-bromo-chromone
CAS Registry Number 33513-40-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H9BrO4
InChI InChI=1S/C12H9BrO4/c1-2-16-12(15)11-6-9(14)8-5-7(13)3-4-10(8)17-11/h3-6H,2H2,1H3
InChIKey BDESGNKGTJQLCI-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G.P. Ellis, J.M. Williams, J. Chem. Soc. Perkin I 2557 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3