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4H-1-Benzopyran-3-carboxylic acid, 2-amino-5,6,7,8-tetrahydro-4-(3-nitrophenyl)-5-oxo-, methyl ester
SpectraBase Compound ID waosLPdAh1
InChI InChI=1S/C17H16N2O6/c1-24-17(21)15-13(9-4-2-5-10(8-9)19(22)23)14-11(20)6-3-7-12(14)25-16(15)18/h2,4-5,8,13H,3,6-7,18H2,1H3
InChIKey CASIIJPPNUDTTI-UHFFFAOYSA-N
Mol Weight 344.32 g/mol
Molecular Formula C17H16N2O6
Exact Mass 344.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVW608UZlwo
Name 4H-1-Benzopyran-3-carboxylic acid, 2-amino-5,6,7,8-tetrahydro-4-(3-nitrophenyl)-5-oxo-, methyl ester
Alternate Name(s) 2-Amino-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid methyl ester Methyl 2-amino-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Methyl 2-azanyl-4-(3-nitrophenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate
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Formula C17H16N2O6
InChI InChI=1S/C17H16N2O6/c1-24-17(21)15-13(9-4-2-5-10(8-9)19(22)23)14-11(20)6-3-7-12(14)25-16(15)18/h2,4-5,8,13H,3,6-7,18H2,1H3
InChIKey CASIIJPPNUDTTI-UHFFFAOYSA-N
Molecular Weight 344.323 g/mol
SMILES NC1=C(C(C2=C(CCCC2=O)O1)c1cc(N(=O)=O)ccc1)C(=O)OC
SPLASH splash10-00di-4791000000-f5719888a5b0836405d0
Source of Spectrum IY-1-4540-7
Wiley ID 1653390