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1H-1,2,4-Triazole-3-carboxamide, N-(4-ethoxyphenyl)-5-(4H-1,2,4-triazol-4-yl)-
SpectraBase Compound ID 4Lum89LuLj9
InChI InChI=1S/C13H13N7O2/c1-2-22-10-5-3-9(4-6-10)16-12(21)11-17-13(19-18-11)20-7-14-15-8-20/h3-8H,2H2,1H3,(H,16,21)(H,17,18,19)
InChIKey MVXWCAISPMMPFH-UHFFFAOYSA-N
Mol Weight 299.29 g/mol
Molecular Formula C13H13N7O2
Exact Mass 299.113073 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQGppq76aoU
Name 1H-1,2,4-Triazole-3-carboxamide, N-(4-ethoxyphenyl)-5-(4H-1,2,4-triazol-4-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N7O2
InChI InChI=1S/C13H13N7O2/c1-2-22-10-5-3-9(4-6-10)16-12(21)11-17-13(19-18-11)20-7-14-15-8-20/h3-8H,2H2,1H3,(H,16,21)(H,17,18,19)
InChIKey MVXWCAISPMMPFH-UHFFFAOYSA-N
Molecular Weight 299.294 g/mol
SMILES N(C(c1nc(-[n]2cnnc2)[nH]n1)=O)c1ccc(cc1)OCC
SPLASH splash10-03ds-2920000000-04326f9f44e679deff7c
Source of Spectrum IY-1-4352-3
Synonyms N-(4-ethoxyphenyl)-3-(1,2,4-triazol-4-yl)-1H-1,2,4-triazole-5-carboxamide
Wiley ID 1651506