For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
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)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 82gqepy8gdz
Name Ethyl 6-chloro-2-oxo-2H-chromene-3-carboxylate
Alternate Name(s) 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
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
Molecular Weight 252.653 g/mol
SMILES C=1(C(Oc2c(C1)cc(Cl)cc2)=O)C(=O)OCC
SPLASH splash10-053r-6940000000-70f43312916d2bbe2392
Source of Spectrum AD-0-2532-0
Wiley ID 1429628