NMR data for compound 5. N-(2-(dimethylamino)-5-(trifluoromethyl)phenyl)-2-phenylacetamide

DOI: 10.14469/hpc/14711 Metadata

Created: 2024-11-01 15:14

Last modified: 2024-11-05 16:43

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Synthesised according to the general procedure, purified by flash column chromatography (EtOAc:Cyclohexane 5% à 50%). Yield = 1.32 g pale pink solid, 4.09 mmol, 82% 1H NMR (700 MHz, CDCl3): δ (ppm) = 8.69 (d, J = 1.6 Hz, 1H), 8.34 (s, 1H), 7.41 (m, 2H), 7.35 (m, 3 H), 7.25 (dd, J = 7.9, 1.3 Hz, 1H), 7.10 (d, J = 8.2 Hz, 1H), 3.79 (s, 2H), 2.35 (s, 6H). 13C NMR (176MHz, CDCl3): δ (ppm) = 169.3, 145.8, 134.6, 133.5, 129.8, 129.3, 127.8, 126.8 (q, JC-F = 32.5 Hz), 124.3 (q, JC-F = 271.8 Hz), 120.7 (q, JC-F¬ = 3.8 Hz), 120.0, 116.2 (q, JC-F = 3.8 Hz), 45.5, 44.0. 19F NMR (659 MHz, CDCl3) δ (ppm) = −62.15 (s). HRMS [C17H17F3N2O + H]+ : Expect 323.1371 observe 323.1360 νmax (solid/cm-1): 3285, 3075, 3038, 2985, 2945, 2870, 2840, 2795, 1664, 1614, 1585, 1531, 1481, 1468, 1425. Melting point: 86 – 88 °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/14749 NMR data for compound 5. N-(2-(dimethylamino)-5-(trifluoromethyl)phenyl)-2-phenylacetamide. 1H
10.14469/hpc/14751 NMR data for compound 5. N-(2-(dimethylamino)-5-(trifluoromethyl)phenyl)-2-phenylacetamide. 19F
10.14469/hpc/14750 NMR data for compound 5. N-(2-(dimethylamino)-5-(trifluoromethyl)phenyl)-2-phenylacetamide. 13C

Subject Keywords

KeywordValue
Inchi InChI=1S/C17H17F3N2O/c1-22(2)15-9-8-13(17(18,19)20)11-14(15)21-16(23)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,21,23)
Inchikey YYWNXFBYWMIYHF-UHFFFAOYSA-N

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