NMR data for compound 16. N-benzyl-1H-pyrazole-3-carboxamide

DOI: 10.14469/hpc/14722 Metadata

Created: 2024-11-01 15:28

Last modified: 2024-11-05 18:28

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 (Acetone : cyclohexane 20% à 80%). Yield 623 mg white powder, 62%. Data is in accordance with reported values.13 1H NMR (400 MHz, DMSO) δ (ppm) = 13.30 (br s, 1H), 8.75 (br s, 1H), 7.78 (br s, 1H), 7.34 – 7.28 (m, 4H), 7.28 – 7.20 (m, 1H), 6.69 (br s, 1H), 4.43 (d, J = 6.3 Hz, 2H). 13C NMR (151 MHz, DMSO) δ (ppm) = 161.6, 146.5, 139.9, 130.1, 128.3 (2C, overlapping peaks), 127.3 (2C, overlapping peaks), 126.7, 105.1, 41.9. HRMS [C11H11N3O+H]+ : Expect 202.0975, Observe 202.0978 Melting point: 140 – 145 °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/14773 NMR data for compound 16. N-benzyl-1H-pyrazole-3-carboxamide. 1H
10.14469/hpc/14774 NMR data for compound 16. N-benzyl-1H-pyrazole-3-carboxamide. 13C

Subject Keywords

KeywordValue
Inchi InChI=1S/C11H11N3O/c15-11(10-6-7-13-14-10)12-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,15)(H,13,14)
Inchikey CORIAVOUWGWLQE-UHFFFAOYSA-N

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