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

View entire compound with spectra: 2 NMR

1H-pyrazole-3,5-dicarboxamide, N~3~,N~5~-bis(2-bromophenyl)-1-methyl-
SpectraBase Compound ID 3SwPOjqU00P
InChI InChI=1S/C18H14Br2N4O2/c1-24-16(18(26)22-14-9-5-3-7-12(14)20)10-15(23-24)17(25)21-13-8-4-2-6-11(13)19/h2-10H,1H3,(H,21,25)(H,22,26)
InChIKey RDAFHCJIUWYKGN-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 7MNK5zmmYil
Name 1H-Pyrazole-3,5-dicarboxamide, N~3~,N~5~-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/c1-24-16(18(26)22-14-9-5-3-7-12(14)20)10-15(23-24)17(25)21-13-8-4-2-6-11(13)19/h2-10H,1H3,(H,21,25)(H,22,26)
InChIKey RDAFHCJIUWYKGN-UHFFFAOYSA-N
Molecular Weight 478.144 g/mol
SMILES N(C1=CC=CC=C1Br)C(C=1C=C(C(NC=2C(Br)=CC=CC2)=O)N(N1)C)=O