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1H-pyrazole-3,5-dicarboxamide, N~3~,N~5~-bis(4-methoxy-2-methylphenyl)-1-methyl-
SpectraBase Compound ID FNcK1zWpmYN
InChI InChI=1S/C22H24N4O4/c1-13-10-15(29-4)6-8-17(13)23-21(27)19-12-20(26(3)25-19)22(28)24-18-9-7-16(30-5)11-14(18)2/h6-12H,1-5H3,(H,23,27)(H,24,28)
InChIKey RRNJWLFKCAPGDZ-UHFFFAOYSA-N
Mol Weight 408.46 g/mol
Molecular Formula C22H24N4O4
Exact Mass 408.179755 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1qfbM2inyGI
Name 1H-Pyrazole-3,5-dicarboxamide, N~3~,N~5~-bis(4-methoxy-2-methylphenyl)-1-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.179755265 u
Formula C22H24N4O4
InChI InChI=1S/C22H24N4O4/c1-13-10-15(29-4)6-8-17(13)23-21(27)19-12-20(26(3)25-19)22(28)24-18-9-7-16(30-5)11-14(18)2/h6-12H,1-5H3,(H,23,27)(H,24,28)
InChIKey RRNJWLFKCAPGDZ-UHFFFAOYSA-N
Molecular Weight 408.458 g/mol
SMILES N(C1=CC=C(C=C1C)OC)C(C=1C=C(C(NC=2C(=CC(OC)=CC2)C)=O)N(N1)C)=O