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5-amino-1-(4-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 2CoaiQsqGZM
InChI InChI=1S/C11H13N5O2/c1-18-8-4-2-7(3-5-8)6-16-10(12)9(11(13)17)14-15-16/h2-5H,6,12H2,1H3,(H2,13,17)
InChIKey QBOPUNNBTOYOBW-UHFFFAOYSA-N
Mol Weight 247.26 g/mol
Molecular Formula C11H13N5O2
Exact Mass 247.106925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VsSBZZybIf
Name 5-amino-1-(4-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C11H13N5O2
InChI InChI=1S/C11H13N5O2/c1-18-8-4-2-7(3-5-8)6-16-10(12)9(11(13)17)14-15-16/h2-5H,6,12H2,1H3,(H2,13,17)
InChIKey QBOPUNNBTOYOBW-UHFFFAOYSA-N
Molecular Weight 247.258 g/mol
SMILES Nc1c(C(=O)N)nn[n]1Cc1ccc(cc1)OC
SPLASH splash10-00di-0910000000-2850420047fa3d7d1b23
Source of Spectrum Y-28-301-3
Synonyms 5-amino-1-p-anisyl-triazole-4-carboxamide 5-amino-1-[(4-methoxyphenyl)methyl]-4-triazolecarboxamide 5-amino-1-[(4-methoxyphenyl)methyl]triazole-4-carboxamide 5-azanyl-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxamide
Wiley ID 1249798