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4H-1-Benzopyran-2-carboxylic acid, 6-amino-7-hydroxy-4-oxo-, ethyl ester
SpectraBase Compound ID HgBvXZ1sHp8
InChI InChI=1S/C12H11NO5/c1-2-17-12(16)11-4-8(14)6-3-7(13)9(15)5-10(6)18-11/h3-5,15H,2,13H2,1H3
InChIKey WSDXFMNGKBAJLQ-UHFFFAOYSA-N
Mol Weight 249.22 g/mol
Molecular Formula C12H11NO5
Exact Mass 249.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JyzPWGuMHN
Name 4H-1-Benzopyran-2-carboxylic acid, 6-amino-7-hydroxy-4-oxo-, ethyl ester
CAS Registry Number 30192-11-1
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO5
InChI InChI=1S/C12H11NO5/c1-2-17-12(16)11-4-8(14)6-3-7(13)9(15)5-10(6)18-11/h3-5,15H,2,13H2,1H3
InChIKey WSDXFMNGKBAJLQ-UHFFFAOYSA-N
Molecular Weight 249.222 g/mol
SMILES Nc1cc2c(cc1O)OC(=CC2=O)C(OCC)=O
SPLASH splash10-006t-0190000000-802464a07289f8b3798a
Source of Spectrum O-5-860-16
Synonyms Ethyl 6-amino-7-hydroxy-4-oxo-4H-chromene-2-carboxylate
Wiley ID 1252039