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4'-methyl-N-(4-(trifluoromethyl)phenyl)-[1,1'-biphenyl]-2-carboxamide
SpectraBase Compound ID 2WAXPclKhok
InChI InChI=1S/C21H16F3NO/c1-14-6-8-15(9-7-14)18-4-2-3-5-19(18)20(26)25-17-12-10-16(11-13-17)21(22,23)24/h2-13H,1H3,(H,25,26)
InChIKey UDPBOHZETCOQHM-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 2LOBu4IgEqF
Name 4'-methyl-N-(4-(trifluoromethyl)phenyl)-[1,1'-biphenyl]-2-carboxamide
Appearance White solid
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Formula C21H16F3NO
InChI InChI=1S/C21H16F3NO/c1-14-6-8-15(9-7-14)18-4-2-3-5-19(18)20(26)25-17-12-10-16(11-13-17)21(22,23)24/h2-13H,1H3,(H,25,26)
InChIKey UDPBOHZETCOQHM-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)cccc1)=O)c1ccc(cc1)C(F)(F)F
SPLASH splash10-0002-0900000000-725f319e3df4ca7b29b7
Source of Spectrum H-104-SM12-3p
Thin-Layer Chromatography Rf = 0.40 (Hex/EtOAc, 4:1)
Wiley ID 1867501