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3-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-hexyl-

View entire compound with spectra: 1 NMR

3-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-hexyl-
SpectraBase Compound ID Ea59xlfJX4
InChI InChI=1S/C22H25F4NO/c1-2-3-4-8-12-27(13-11-17-9-6-5-7-10-17)21(28)18-14-19(22(24,25)26)16-20(23)15-18/h5-7,9-10,14-16H,2-4,8,11-13H2,1H3
InChIKey XXMNXNUQZMEOPI-UHFFFAOYSA-N
Mol Weight 395.44 g/mol
Molecular Formula C22H25F4NO
Exact Mass 395.187227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9cb7hB2qcoY
Name 3-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-hexyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.187227080 u
Formula C22H25F4NO
InChI InChI=1S/C22H25F4NO/c1-2-3-4-8-12-27(13-11-17-9-6-5-7-10-17)21(28)18-14-19(22(24,25)26)16-20(23)15-18/h5-7,9-10,14-16H,2-4,8,11-13H2,1H3
InChIKey XXMNXNUQZMEOPI-UHFFFAOYSA-N
Molecular Weight 395.442 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=C(C=C(F)C1)C(F)(F)F)CCCCCC