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1H-1,2,3-triazole-4-carboxamide, N-[4-(acetylamino)phenyl]-1,5-diphenyl-
SpectraBase Compound ID HlRnNgoo5mE
InChI InChI=1S/C23H19N5O2/c1-16(29)24-18-12-14-19(15-13-18)25-23(30)21-22(17-8-4-2-5-9-17)28(27-26-21)20-10-6-3-7-11-20/h2-15H,1H3,(H,24,29)(H,25,30)
InChIKey MUUSVKWZIXXBJO-UHFFFAOYSA-N
Mol Weight 397.44 g/mol
Molecular Formula C23H19N5O2
Exact Mass 397.153875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3eCfQVkPJa5
Name 1H-1,2,3-Triazole-4-carboxamide, N-[4-(acetylamino)phenyl]-1,5-diphenyl-
Comments Computed using HOSE algorithm
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Exact Mass 397.153874870 u
Formula C23H19N5O2
InChI InChI=1S/C23H19N5O2/c1-16(29)24-18-12-14-19(15-13-18)25-23(30)21-22(17-8-4-2-5-9-17)28(27-26-21)20-10-6-3-7-11-20/h2-15H,1H3,(H,24,29)(H,25,30)
InChIKey MUUSVKWZIXXBJO-UHFFFAOYSA-N
Molecular Weight 397.438 g/mol
SMILES N(C(C1=C(N(C2=CC=CC=C2)N=N1)C=1C=CC=CC1)=O)C=1C=CC(NC(=O)C)=CC1