NMR data for compound 22. N-(3,5-bis(trifluoromethyl)phenyl)-2-phenylacetamide

DOI: 10.14469/hpc/14732 Metadata

Created: 2024-11-01 16:56

Last modified: 2024-11-05 18:34

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Synthesised according to the general procedure using toluene as reaction solvent, with 46 hours reaction time. Purified by flash column chromatography (EtOAc : Cyclohexane 5 à 50%). Yield = 1.625 g white solid, 94%. Analytical data is in accordance with literature reports.12 1H NMR (700 MHz, CDCl3) δ (ppm) = 7.93 (s, 2H), 7.58 (s, 1H), 7.43 (t, J = 7.4 Hz, 2H), 7.38 (m, 2H), 7.33 (d, J = 7.6 Hz, 2H), 3.78 (s, 2H). 13C NMR (176 MHz, CDCl3) δ (ppm) = 169.6, 139.1, 133.6, 132.5 (q, JC-F = 33.6 Hz), 129.6, 129.6, 128.3, 123.12 (q, JC-F = 272.8 Hz), 119.6 (m), 117.9 (sept, JC-F = 3.6 Hz), 44.9 19F NMR (659 MHz, CDCl3) δ (ppm) = −63.04. HRMS [C16H10NOF6]- : Expected 346.0672, observed 346.0668 Melting point: 126 – 127 °C

Member of collection / collaboration

DOIDescription
10.14469/hpc/14635 Borate-Catalysed Direct Amidation Reactions of Coordinating Substrates. NMR data

Members

DOIDescription
10.14469/hpc/14788 NMR data for compound 22. N-(3,5-bis(trifluoromethyl)phenyl)-2-phenylacetamide. 1H
10.14469/hpc/14789 NMR data for compound 22. N-(3,5-bis(trifluoromethyl)phenyl)-2-phenylacetamide. 13C
10.14469/hpc/14790 NMR data for compound 22. N-(3,5-bis(trifluoromethyl)phenyl)-2-phenylacetamide. 19F

Subject Keywords

KeywordValue
Inchi InChI=1S/C16H11F6NO/c17-15(18,19)11-7-12(16(20,21)22)9-13(8-11)23-14(24)6-10-4-2-1-3-5-10/h1-5,7-9H,6H2,(H,23,24)
Inchikey AUBFVXCWFSOLAN-UHFFFAOYSA-N

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