7-Amino-6-keto-benzo[c]chromene-8,9-dicarboxylic acid diethyl ester

SpectraBase Compound ID	K4OUyFSDE88
InChI	InChI=1S/C19H17NO6/c1-3-24-17(21)12-9-11-10-7-5-6-8-13(10)26-19(23)14(11)16(20)15(12)18(22)25-4-2/h5-9H,3-4,20H2,1-2H3
InChIKey	XGDZQOXAUGQJIC-UHFFFAOYSA-N Google Search
Mol Weight	355.35 g/mol
Molecular Formula	C19H17NO6
Exact Mass	355.105587 g/mol

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SpectraBase Spectrum ID	KtMb11LlqCJ
Name	7-Amino-6-keto-benzo[C]chromene-8,9-dicarboxylic acid diethyl ester
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	355.105587265 u
Formula	C19H17NO6
InChI	InChI=1S/C19H17NO6/c1-3-24-17(21)12-9-11-10-7-5-6-8-13(10)26-19(23)14(11)16(20)15(12)18(22)25-4-2/h5-9H,3-4,20H2,1-2H3
InChIKey	XGDZQOXAUGQJIC-UHFFFAOYSA-N
Molecular Weight	355.346 g/mol
SMILES	C=1C=C2C(OC(C=3C(=C(C(=CC23)C(OCC)=O)C(OCC)=O)N)=O)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.920272