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4'-methyl-N-phenyl-4-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamide
SpectraBase Compound ID KKqfO4aXTHc
InChI InChI=1S/C21H16F3NO/c1-14-7-9-15(10-8-14)18-12-11-16(21(22,23)24)13-19(18)20(26)25-17-5-3-2-4-6-17/h2-13H,1H3,(H,25,26)
InChIKey IFCOXFNNMUSADZ-UHFFFAOYSA-N
Mol Weight 355.36 g/mol
Molecular Formula C21H16F3NO
Exact Mass 355.118399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QaK5a4d97w
Name 4'-methyl-N-phenyl-4-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamide
Appearance White solid
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Formula C21H16F3NO
InChI InChI=1S/C21H16F3NO/c1-14-7-9-15(10-8-14)18-12-11-16(21(22,23)24)13-19(18)20(26)25-17-5-3-2-4-6-17/h2-13H,1H3,(H,25,26)
InChIKey IFCOXFNNMUSADZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/hlca.202100089
Molecular Weight 355.360 g/mol
Reported Formula C21H16NOF3
SMILES N(C(c1c(-c2ccc(C)cc2)ccc(c1)C(F)(F)F)=O)c1ccccc1
SPLASH splash10-03di-0192000000-2a521bea232723297883
Source of Spectrum H-104-SM9-3e
Thin-Layer Chromatography Rf = 0.51 (Hex/EtOAc, 4:1)
Wiley ID 1867490