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1H-pyrazole-3,4-dicarboxamide, N~3~,N~4~-bis(2-bromophenyl)-1-methyl-

View entire compound with spectra: 2 NMR

1H-pyrazole-3,4-dicarboxamide, N~3~,N~4~-bis(2-bromophenyl)-1-methyl-
SpectraBase Compound ID JS2gX5rX4HZ
InChI InChI=1S/C18H14Br2N4O2/c1-24-10-11(17(25)21-14-8-4-2-6-12(14)19)16(23-24)18(26)22-15-9-5-3-7-13(15)20/h2-10H,1H3,(H,21,25)(H,22,26)
InChIKey ZZKBVNRTHRBDQX-UHFFFAOYSA-N
Mol Weight 478.14 g/mol
Molecular Formula C18H14Br2N4O2
Exact Mass 475.948352 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 801Bf1SZaVm
Name 1H-Pyrazole-3,4-dicarboxamide, N~3~,N~4~-bis(2-bromophenyl)-1-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.948351705 u
Formula C18H14Br2N4O2
InChI InChI=1S/C18H14Br2N4O2/c1-24-10-11(17(25)21-14-8-4-2-6-12(14)19)16(23-24)18(26)22-15-9-5-3-7-13(15)20/h2-10H,1H3,(H,21,25)(H,22,26)
InChIKey ZZKBVNRTHRBDQX-UHFFFAOYSA-N
Molecular Weight 478.144 g/mol
SMILES N(C(C1=CN(N=C1C(=O)NC1=CC=CC=C1Br)C)=O)C=1C(Br)=CC=CC1