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2-(2-Benzyl-phenoxy)-5-trifluoromethyl-phenylamine, N-acetyl-
SpectraBase Compound ID 57wrn7eo5Q2
InChI InChI=1S/C22H18F3NO2/c1-15(27)26-19-14-18(22(23,24)25)11-12-21(19)28-20-10-6-5-9-17(20)13-16-7-3-2-4-8-16/h2-12,14H,13H2,1H3,(H,26,27)
InChIKey ZZKQMGBIJAHYET-UHFFFAOYSA-N
Mol Weight 385.39 g/mol
Molecular Formula C22H18F3NO2
Exact Mass 385.128963 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7VgXKlLoLoR
Name 2-(2-Benzyl-phenoxy)-5-trifluoromethyl-phenylamine, N-acetyl-
Comments Computed using HOSE algorithm
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Exact Mass 385.128963311 u
Formula C22H18F3NO2
InChI InChI=1S/C22H18F3NO2/c1-15(27)26-19-14-18(22(23,24)25)11-12-21(19)28-20-10-6-5-9-17(20)13-16-7-3-2-4-8-16/h2-12,14H,13H2,1H3,(H,26,27)
InChIKey ZZKQMGBIJAHYET-UHFFFAOYSA-N
Molecular Weight 385.386 g/mol
SMILES C(F)(F)(F)C1=CC(=C(C=C1)OC1=C(C=CC=C1)CC1=CC=CC=C1)NC(C)=O