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1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carboxylic acid
SpectraBase Compound ID 1sjRLeFqdiK
InChI InChI=1S/C8H11N7O3/c1-14(2)3-4-5(8(16)17)10-13-15(4)7-6(9)11-18-12-7/h3H2,1-2H3,(H2,9,11)(H,16,17)
InChIKey ZWFIUXTWQRVAQO-UHFFFAOYSA-N
Mol Weight 253.22 g/mol
Molecular Formula C8H11N7O3
Exact Mass 253.092337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HyVPoYWuJ5
Name 1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carboxylic acid
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Formula C8H11N7O3
InChI InChI=1S/C8H11N7O3/c1-14(2)3-4-5(8(16)17)10-13-15(4)7-6(9)11-18-12-7/h3H2,1-2H3,(H2,9,11)(H,16,17)
InChIKey ZWFIUXTWQRVAQO-UHFFFAOYSA-N
Molecular Weight 253.222 g/mol
SMILES Nc1c(-[n]2c(c(C(=O)O)nn2)CN(C)C)non1
SPLASH splash10-0a4i-9200000000-15de3ef042b06db3386a
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(dimethylaminomethyl)triazole-4-carboxylic acid 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylammonio)methyl]-4-triazolecarboxylate 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylammonio)methyl]triazole-4-carboxylate 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylazaniumyl)methyl]triazole-4-carboxylate 1-(4-Amino-furazan-3-yl)-5-dimethylaminomethyl-1H-[1,2,3]triazole-4-carboxylic acid 1-(4-aminofurazan-3-yl)-5-[(dimethylammonio)methyl]triazole-4-carboxylate 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(dimethylazaniumyl)methyl]-1,2,3-triazole-4-carboxylate 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-4-triazolecarboxylic acid 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]triazole-4-carboxylic acid 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-1,2,3-triazole-4-carboxylic acid
Wiley ID 1462008