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benzamide, 4-benzoyl-N-[3,5-bis(trifluoromethyl)phenyl]-

View entire compound with spectra: 2 NMR

benzamide, 4-benzoyl-N-[3,5-bis(trifluoromethyl)phenyl]-
SpectraBase Compound ID DGhHJhsYFiH
InChI InChI=1S/C22H13F6NO2/c23-21(24,25)16-10-17(22(26,27)28)12-18(11-16)29-20(31)15-8-6-14(7-9-15)19(30)13-4-2-1-3-5-13/h1-12H,(H,29,31)
InChIKey HJJBTSISINDSNN-UHFFFAOYSA-N
Mol Weight 437.34 g/mol
Molecular Formula C22H13F6NO2
Exact Mass 437.085048 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 35KDNWjForF
Name Benzamide, 4-benzoyl-N-[3,5-bis(trifluoromethyl)phenyl]-
Comments Computed using HOSE algorithm
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Exact Mass 437.085047639 u
Formula C22H13F6NO2
InChI InChI=1S/C22H13F6NO2/c23-21(24,25)16-10-17(22(26,27)28)12-18(11-16)29-20(31)15-8-6-14(7-9-15)19(30)13-4-2-1-3-5-13/h1-12H,(H,29,31)
InChIKey HJJBTSISINDSNN-UHFFFAOYSA-N
Molecular Weight 437.341 g/mol
SMILES N(C(C=1C=CC(C(=O)C2=CC=CC=C2)=CC1)=O)C=1C=C(C(F)(F)F)C=C(C(F)(F)F)C1