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N-(5-methyl-4-phenyltriazol-1-yl)-4-nitrobenzamide
SpectraBase Compound ID AOD7TfUmf0q
InChI InChI=1S/C16H13N5O3/c1-11-15(12-5-3-2-4-6-12)17-19-20(11)18-16(22)13-7-9-14(10-8-13)21(23)24/h2-10H,1H3,(H,18,22)
InChIKey SBUPSZQSBWWRHR-UHFFFAOYSA-N
Mol Weight 323.31 g/mol
Molecular Formula C16H13N5O3
Exact Mass 323.101839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cy5no1pdTeb
Name N-(5-methyl-4-phenyl-1,2,3-triazol-1-yl)-4-nitro-benzamide
CAS Registry Number 113631-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N5O3
InChI InChI=1S/C16H13N5O3/c1-11-15(12-5-3-2-4-6-12)17-19-20(11)18-16(22)13-7-9-14(10-8-13)21(23)24/h2-10H,1H3,(H,18,22)
InChIKey SBUPSZQSBWWRHR-UHFFFAOYSA-N
Molecular Weight 323.312 g/mol
SMILES N([n]1c(c(-c2ccccc2)nn1)C)C(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-014i-1900000000-9ec34d9861169c0cdf97
Source of Spectrum Y-24-1277-4
Synonyms N-(5-methyl-4-phenyl-1-triazolyl)-4-nitrobenzamide N-(5-methyl-4-phenyl-triazol-1-yl)-4-nitro-benzamide
Wiley ID 1322344