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N-[4-(5-Methyl-1H-1,2,3-triazol-1-yl)phenyl]benzamide
SpectraBase Compound ID FNlNamxf3Em
InChI InChI=1S/C16H14N4O/c1-12-11-17-19-20(12)15-9-7-14(8-10-15)18-16(21)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,21)
InChIKey CLSNFEJAANKOIJ-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C16H14N4O
Exact Mass 278.116761 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkLwJaQyI0
Name N-[4-(5-Methyl-1H-1,2,3-triazol-1-yl)phenyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 278.116761086 u
Formula C16H14N4O
InChI InChI=1S/C16H14N4O/c1-12-11-17-19-20(12)15-9-7-14(8-10-15)18-16(21)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,21)
InChIKey CLSNFEJAANKOIJ-UHFFFAOYSA-N
SMILES C=1N=NN(C1C)C1=CC=C(C=C1)NC(=O)C1=CC=CC=C1