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

View entire compound with spectra: 1 NMR

3-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-nonyl-
SpectraBase Compound ID LtTWkHTyV5g
InChI InChI=1S/C25H31F4NO/c1-2-3-4-5-6-7-11-15-30(16-14-20-12-9-8-10-13-20)24(31)21-17-22(25(27,28)29)19-23(26)18-21/h8-10,12-13,17-19H,2-7,11,14-16H2,1H3
InChIKey QVBKTHZGTWETOB-UHFFFAOYSA-N
Mol Weight 437.52 g/mol
Molecular Formula C25H31F4NO
Exact Mass 437.234177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 47bBVdAZqkn
Name 3-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-nonyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.234177273 u
Formula C25H31F4NO
InChI InChI=1S/C25H31F4NO/c1-2-3-4-5-6-7-11-15-30(16-14-20-12-9-8-10-13-20)24(31)21-17-22(25(27,28)29)19-23(26)18-21/h8-10,12-13,17-19H,2-7,11,14-16H2,1H3
InChIKey QVBKTHZGTWETOB-UHFFFAOYSA-N
Molecular Weight 437.523 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=C(C=C(F)C1)C(F)(F)F)CCCCCCCCC