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1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methyl-1-piperidinyl)methyl]-, methyl ester
SpectraBase Compound ID 3HKgmUOgjkY
InChI InChI=1S/C13H19N7O3/c1-8-3-5-19(6-4-8)7-9-10(13(21)22-2)15-18-20(9)12-11(14)16-23-17-12/h8H,3-7H2,1-2H3,(H2,14,16)
InChIKey CFKCOWSKGMZMFT-UHFFFAOYSA-N
Mol Weight 321.34 g/mol
Molecular Formula C13H19N7O3
Exact Mass 321.154937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhzGda5TMba
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methyl-1-piperidinyl)methyl]-4-triazolecarboxylic acid methyl ester
Alternate Name(s) 1-(4-aminofurazan-3-yl)-5-[(4-methylpiperidino)methyl]triazole-4-carboxylic acid methyl ester Methyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methyl-1-piperidyl)methyl]triazole-4-carboxylate Methyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]triazole-4-carboxylate Methyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-1,2,3-triazole-4-carboxylate
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Formula C13H19N7O3
InChI InChI=1S/C13H19N7O3/c1-8-3-5-19(6-4-8)7-9-10(13(21)22-2)15-18-20(9)12-11(14)16-23-17-12/h8H,3-7H2,1-2H3,(H2,14,16)
InChIKey CFKCOWSKGMZMFT-UHFFFAOYSA-N
Molecular Weight 321.341 g/mol
SMILES Nc1c(-[n]2c(c(C(=O)OC)nn2)CN2CCC(CC2)C)non1
SPLASH splash10-03di-9700000000-4e1334e68b88023e5235
Wiley ID 1511374