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2-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-pentyl-

View entire compound with spectra: 1 NMR

2-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-pentyl-
SpectraBase Compound ID 9d2RezqgZ13
InChI InChI=1S/C21H23F4NO/c1-2-3-7-13-26(14-12-16-8-5-4-6-9-16)20(27)18-15-17(21(23,24)25)10-11-19(18)22/h4-6,8-11,15H,2-3,7,12-14H2,1H3
InChIKey ZBBKZLXZGWAJKS-UHFFFAOYSA-N
Mol Weight 381.41 g/mol
Molecular Formula C21H23F4NO
Exact Mass 381.171577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1yaSo8XPUPJ
Name 2-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-pentyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.171577016 u
Formula C21H23F4NO
InChI InChI=1S/C21H23F4NO/c1-2-3-7-13-26(14-12-16-8-5-4-6-9-16)20(27)18-15-17(21(23,24)25)10-11-19(18)22/h4-6,8-11,15H,2-3,7,12-14H2,1H3
InChIKey ZBBKZLXZGWAJKS-UHFFFAOYSA-N
Molecular Weight 381.415 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=C(C=CC1F)C(F)(F)F)CCCCC