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1-(4-Chlorophenyl)-N-[(3,4-difluorophenyl)methyl]-1,2,3-triazole-4-carboxamide

View entire compound with spectra: 1 NMR

1-(4-Chlorophenyl)-N-[(3,4-difluorophenyl)methyl]-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 3VyoRH9lSPz
InChI InChI=1S/C16H11ClF2N4O/c17-11-2-4-12(5-3-11)23-9-15(21-22-23)16(24)20-8-10-1-6-13(18)14(19)7-10/h1-7,9H,8H2,(H,20,24)
InChIKey QIDBGFRITAJTGT-UHFFFAOYSA-N
Mol Weight 348.74 g/mol
Molecular Formula C16H11ClF2N4O
Exact Mass 348.058945 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDBtWLMs2Pl
Name 1-(4-Chlorophenyl)-N-[(3,4-difluorophenyl)methyl]-1,2,3-triazole-4-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.058945015 u
Formula C16H11ClF2N4O
InChI InChI=1S/C16H11ClF2N4O/c17-11-2-4-12(5-3-11)23-9-15(21-22-23)16(24)20-8-10-1-6-13(18)14(19)7-10/h1-7,9H,8H2,(H,20,24)
InChIKey QIDBGFRITAJTGT-UHFFFAOYSA-N
Molecular Weight 348.741 g/mol
SMILES C(NCC1=CC=C(C(=C1)F)F)(=O)C1=CN(C2=CC=C(C=C2)Cl)N=N1