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6-chloro-2-oxo-2H-1-benzopyran-3-carboxylic acid, ethyl ester
SpectraBase Compound ID FCNhxqddt7p
InChI InChI=1S/C12H9ClO4/c1-2-16-11(14)9-6-7-5-8(13)3-4-10(7)17-12(9)15/h3-6H,2H2,1H3
InChIKey HDBCARVARPQBKI-UHFFFAOYSA-N
Mol Weight 252.65 g/mol
Molecular Formula C12H9ClO4
Exact Mass 252.018936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLJf50CzqGb
Name Ethyl 6-chloro-2-oxo-2H-chromene-3-carboxylate
CAS Registry Number 70384-80-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9ClO4
InChI InChI=1S/C12H9ClO4/c1-2-16-11(14)9-6-7-5-8(13)3-4-10(7)17-12(9)15/h3-6H,2H2,1H3
InChIKey HDBCARVARPQBKI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200505297
Molecular Weight 252.653 g/mol
SMILES c1(ccc2OC(C(=Cc2c1)C(OCC)=O)=O)Cl
SPLASH splash10-0pc0-0790000000-98b1532e145846d512b2
Source of Spectrum ASC-348-297/SM4-1c
Synonyms 6-Chloro-2-keto-chromene-3-carboxylic acid ethyl ester 6-Chloro-3-Carbethoxycoumarin 6-Chloro-2-oxo-1-benzopyran-3-carboxylic acid ethyl ester Chromane-3-carboxylic acid, 6-chloro-2-oxo-, ethyl ester Ethyl 6-chloranyl-2-oxidanylidene-chromene-3-carboxylate Ethyl 6-chloro-2-oxo-chromene-3-carboxylate Ethyl 6-chloro-2-oxochromene-3-carboxylate
Wiley ID 1765131