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1H-[1,2,3]Triazole-4-carboxylic acid, 5-[(4-acetylaminophenylamino)methyl]-1-(4-aminofurazan-3-yl)-, ethyl ester
SpectraBase Compound ID JxFOoF80kgR
InChI InChI=1S/C16H18N8O4/c1-3-27-16(26)13-12(24(23-20-13)15-14(17)21-28-22-15)8-18-10-4-6-11(7-5-10)19-9(2)25/h4-7,18H,3,8H2,1-2H3,(H2,17,21)(H,19,25)
InChIKey UZGIHNWBRYWGDI-UHFFFAOYSA-N
Mol Weight 386.37 g/mol
Molecular Formula C16H18N8O4
Exact Mass 386.145101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ia0PxxPzTBF
Name 1H-[1,2,3]Triazole-4-carboxylic acid, 5-[(4-acetylaminophenylamino)methyl]-1-(4-aminofurazan-3-yl)-, ethyl ester
Alternate Name(s) 5-[(4-acetamidoanilino)methyl]-1-(4-amino-1,2,5-oxadiazol-3-yl)-4-triazolecarboxylic acid ethyl ester 5-[(4-acetamidoanilino)methyl]-1-(4-aminofurazan-3-yl)triazole-4-carboxylic acid ethyl ester Ethyl 5-[(4-acetamidoanilino)methyl]-1-(4-amino-1,2,5-oxadiazol-3-yl)triazole-4-carboxylate Ethyl 5-[[(4-acetamidophenyl)amino]methyl]-1-(4-azanyl-1,2,5-oxadiazol-3-yl)-1,2,3-triazole-4-carboxylate
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Formula C16H18N8O4
InChI InChI=1S/C16H18N8O4/c1-3-27-16(26)13-12(24(23-20-13)15-14(17)21-28-22-15)8-18-10-4-6-11(7-5-10)19-9(2)25/h4-7,18H,3,8H2,1-2H3,(H2,17,21)(H,19,25)
InChIKey UZGIHNWBRYWGDI-UHFFFAOYSA-N
Molecular Weight 386.372 g/mol
SMILES Nc1c(-[n]2c(CNc3ccc(NC(=O)C)cc3)c(nn2)C(=O)OCC)non1
SPLASH splash10-03di-4910000000-0c6b3caccb973dfa5448
Wiley ID 1441538