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Benzamide, 4-methoxy-N-[3-methyl-1-[(3-methylphenyl)methyl]-1H-pyrazol-5-yl]-
SpectraBase Compound ID C7P6QZnuaP9
InChI InChI=1S/C20H21N3O2/c1-14-5-4-6-16(11-14)13-23-19(12-15(2)22-23)21-20(24)17-7-9-18(25-3)10-8-17/h4-12H,13H2,1-3H3,(H,21,24)
InChIKey BSNJVKKUKVBOMB-UHFFFAOYSA-N
Mol Weight 335.41 g/mol
Molecular Formula C20H21N3O2
Exact Mass 335.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DfD22B1IIeh
Name Benzamide, 4-methoxy-N-[3-methyl-1-[(3-methylphenyl)methyl]-1H-pyrazol-5-yl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.163376926 u
Formula C20H21N3O2
InChI InChI=1S/C20H21N3O2/c1-14-5-4-6-16(11-14)13-23-19(12-15(2)22-23)21-20(24)17-7-9-18(25-3)10-8-17/h4-12H,13H2,1-3H3,(H,21,24)
InChIKey BSNJVKKUKVBOMB-UHFFFAOYSA-N
Molecular Weight 335.407 g/mol
SMILES C(C1=CC(=CC=C1)C)N1C(=CC(=N1)C)NC(C1=CC=C(C=C1)OC)=O