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6-bromo-2-oxo-2H-1-benzopyran-3-carboxylic acid, ethyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, 1 UV-Vis, and 1 MS (GC)

6-bromo-2-oxo-2H-1-benzopyran-3-carboxylic acid, ethyl ester
SpectraBase Compound ID 2qvf7brVuEL
InChI InChI=1S/C12H9BrO4/c1-2-16-11(14)9-6-7-5-8(13)3-4-10(7)17-12(9)15/h3-6H,2H2,1H3
InChIKey RXGDNKCWEKUYQA-UHFFFAOYSA-N
Mol Weight 297.1 g/mol
Molecular Formula C12H9BrO4
Exact Mass 295.968422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1vvIeURhC9
Name Ethyl 6-bromo-2-oxo-2H-chromene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrO4
InChI InChI=1S/C12H9BrO4/c1-2-16-11(14)9-6-7-5-8(13)3-4-10(7)17-12(9)15/h3-6H,2H2,1H3
InChIKey RXGDNKCWEKUYQA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cctc.201701527
Molecular Weight 297.104 g/mol
SMILES c1(cc2c(cc1)OC(C(=C2)C(OCC)=O)=O)Br
SPLASH splash10-0uds-2290000000-a57e947d7e28e0aedfdf
Source of Spectrum CCC-10-SM15-S47
Wiley ID 1812774