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1-(4-Amino-1,2,5-oxadiazol-3-yl)-4-methyl-1H-1,2,3-triazole-5-carboxylic acid
SpectraBase Compound ID H8pnbCz31dY
InChI InChI=1S/C6H6N6O3/c1-2-3(6(13)14)12(11-8-2)5-4(7)9-15-10-5/h1H3,(H2,7,9)(H,13,14)
InChIKey PUHAXUPONHAKGH-UHFFFAOYSA-N
Mol Weight 210.15 g/mol
Molecular Formula C6H6N6O3
Exact Mass 210.050138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9RfKT3H9Vt
Name 1-(4-Amino-1,2,5-oxadiazol-3-yl)-4-methyl-1H-1,2,3-triazole-5-carboxylic acid
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Formula C6H6N6O3
InChI InChI=1S/C6H6N6O3/c1-2-3(6(13)14)12(11-8-2)5-4(7)9-15-10-5/h1H3,(H2,7,9)(H,13,14)
InChIKey PUHAXUPONHAKGH-UHFFFAOYSA-N
Molecular Weight 210.153 g/mol
SMILES Nc1c(-[n]2c(C(=O)O)c(nn2)C)non1
SPLASH splash10-0udi-9100000000-921af2507d362ce07c88
Synonyms 3-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-4-triazolecarboxylic acid 3-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-triazole-4-carboxylic acid 3-(4-Amino-furazan-3-yl)-5-methyl-3H-[1,2,3]triazole-4-carboxylic acid 3-(4-aminofurazan-3-yl)-5-methyl-triazole-4-carboxylic acid 3-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-methyl-1,2,3-triazole-4-carboxylic acid
Wiley ID 1465863