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2-Chromancarboxylic acid, 6-amino-4-oxo-, ethyl ester
SpectraBase Compound ID KgoqEdhKLgg
InChI InChI=1S/C12H13NO4/c1-2-16-12(15)11-6-9(14)8-5-7(13)3-4-10(8)17-11/h3-5,11H,2,6,13H2,1H3
InChIKey WCJKHJIVHSYBOD-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QOg0L8xhOL
Name 2-Chromancarboxylic acid, 6-amino-4-oxo-, ethyl ester
Alternate Name(s) Ethyl 6-amino-4-oxo-2-chromanecarboxylate 6-Amino-4-keto-chroman-2-carboxylic acid ethyl ester 6-Amino-4-oxo-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid ethyl ester Ethyl 6-amino-4-oxo-2,3-dihydrochromene-2-carboxylate Ethyl 6-amino-4-oxo-chromane-2-carboxylate Ethyl 6-azanyl-4-oxidanylidene-2,3-dihydrochromene-2-carboxylate Ethyl-6-amino-4-oxochromen-2-carboxylate
CAS Registry Number 30095-82-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-2-16-12(15)11-6-9(14)8-5-7(13)3-4-10(8)17-11/h3-5,11H,2,6,13H2,1H3
InChIKey WCJKHJIVHSYBOD-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
SMILES Nc1ccc2c(c1)C(CC(C(=O)OCC)O2)=O
SPLASH splash10-01p9-1940000000-d4870446307806294087
Source of Spectrum O-5-860-23
Wiley ID 1236989