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4-(ethoxycarbonyl)benzyl 4-amino-1,2,5-oxadiazole-3-carboxylate
SpectraBase Compound ID 9gy0KNtywBO
InChI InChI=1S/C13H13N3O5/c1-2-19-12(17)9-5-3-8(4-6-9)7-20-13(18)10-11(14)16-21-15-10/h3-6H,2,7H2,1H3,(H2,14,16)
InChIKey GMDWYBPPRFSHBI-UHFFFAOYSA-N
Mol Weight 291.26 g/mol
Molecular Formula C13H13N3O5
Exact Mass 291.085521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62p8BD9A6f7
Name 4-(ethoxycarbonyl)benzyl 4-amino-1,2,5-oxadiazole-3-carboxylate
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Formula C13H13N3O5
InChI InChI=1S/C13H13N3O5/c1-2-19-12(17)9-5-3-8(4-6-9)7-20-13(18)10-11(14)16-21-15-10/h3-6H,2,7H2,1H3,(H2,14,16)
InChIKey GMDWYBPPRFSHBI-UHFFFAOYSA-N
Molecular Weight 291.263 g/mol
SMILES Nc1c(non1)C(=O)OCc1ccc(cc1)C(OCC)=O
SPLASH splash10-03dr-5910000000-9c47849630786b4455f5
Synonyms (4-ethoxycarbonylphenyl)methyl 4-amino-1,2,5-oxadiazole-3-carboxylate (4-ethoxycarbonylphenyl)methyl 4-azanyl-1,2,5-oxadiazole-3-carboxylate 4-Amino-1,2,5-oxadiazole-3-carboxylic acid (4-ethoxycarbonylphenyl)methyl ester 4-Aminofurazan-3-carboxylic acid (4-carbethoxybenzyl) ester Furazan-3-carboxylic acid, 4-amino-, 4-ethoxycarbonylbenzyl ester
Wiley ID 1438442