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1H-Pyrazole-3-carboxylic acid [(2,6-dimethyl-phenylcarbamoyl)-phenyl-methyl]-amide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1H-Pyrazole-3-carboxylic acid [(2,6-dimethyl-phenylcarbamoyl)-phenyl-methyl]-amide
SpectraBase Compound ID KLwQMrd5Z9i
InChI InChI=1S/C20H20N4O2/c1-13-7-6-8-14(2)17(13)22-20(26)18(15-9-4-3-5-10-15)23-19(25)16-11-12-21-24-16/h3-12,18H,1-2H3,(H,21,24)(H,22,26)(H,23,25)
InChIKey WCVVJGSOXZJNLX-UHFFFAOYSA-N
Mol Weight 348.41 g/mol
Molecular Formula C20H20N4O2
Exact Mass 348.158626 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74LlPyJg9fc
Name 1H-Pyrazole-3-carboxylic acid [(2,6-dimethyl-phenylcarbamoyl)-phenyl-methyl]-amide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.158625898 u
Formula C20H20N4O2
InChI InChI=1S/C20H20N4O2/c1-13-7-6-8-14(2)17(13)22-20(26)18(15-9-4-3-5-10-15)23-19(25)16-11-12-21-24-16/h3-12,18H,1-2H3,(H,21,24)(H,22,26)(H,23,25)
InChIKey WCVVJGSOXZJNLX-UHFFFAOYSA-N
Molecular Weight 348.406 g/mol
SMILES C(NC1=C(C=CC=C1C)C)(C(NC(C1=NNC=C1)=O)C1=CC=CC=C1)=O