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2,4-Difluoro-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
SpectraBase Compound ID ChgnX6nfJHi
InChI InChI=1S/C22H15F2N3O/c23-16-11-12-18(19(24)13-16)22(28)25-21-14-20(15-7-3-1-4-8-15)26-27(21)17-9-5-2-6-10-17/h1-14H,(H,25,28)
InChIKey RIRCBNWUZKNJCQ-UHFFFAOYSA-N
Mol Weight 375.38 g/mol
Molecular Formula C22H15F2N3O
Exact Mass 375.118318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4D4lB2gZr4D
Name 2,4-Difluoro-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 375.118318440 u
Formula C22H15F2N3O
InChI InChI=1S/C22H15F2N3O/c23-16-11-12-18(19(24)13-16)22(28)25-21-14-20(15-7-3-1-4-8-15)26-27(21)17-9-5-2-6-10-17/h1-14H,(H,25,28)
InChIKey RIRCBNWUZKNJCQ-UHFFFAOYSA-N
Molecular Weight 375.379 g/mol
SMILES C=1(N(N=C(C1)C1=CC=CC=C1)C=1C=CC=CC1)NC(C=1C(=CC(=CC1)F)F)=O