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1-methyl-N~3~,N~5~-bis(2-methylphenyl)-1H-pyrazole-3,5-dicarboxamide

View entire compound with spectra: 3 NMR

1-methyl-N~3~,N~5~-bis(2-methylphenyl)-1H-pyrazole-3,5-dicarboxamide
SpectraBase Compound ID IL5O5gJWvg0
InChI InChI=1S/C20H20N4O2/c1-13-8-4-6-10-15(13)21-19(25)17-12-18(24(3)23-17)20(26)22-16-11-7-5-9-14(16)2/h4-12H,1-3H3,(H,21,25)(H,22,26)
InChIKey NPMAGUUIVQNEQB-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 FLEp28LFizR
Name 1-Methyl-N~3~,N~5~-bis(2-methylphenyl)-1H-pyrazole-3,5-dicarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 348.158625898 u
Formula C20H20N4O2
InChI InChI=1S/C20H20N4O2/c1-13-8-4-6-10-15(13)21-19(25)17-12-18(24(3)23-17)20(26)22-16-11-7-5-9-14(16)2/h4-12H,1-3H3,(H,21,25)(H,22,26)
InChIKey NPMAGUUIVQNEQB-UHFFFAOYSA-N
Molecular Weight 348.406 g/mol
SMILES N(C(C=1C=C(C(NC2=C(C)C=CC=C2)=O)N(N1)C)=O)C=1C(C)=CC=CC1