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

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2-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-tetradecyl-
SpectraBase Compound ID DPoYtxLQCbJ
InChI InChI=1S/C30H41F4NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-22-35(23-21-25-17-14-13-15-18-25)29(36)27-24-26(30(32,33)34)19-20-28(27)31/h13-15,17-20,24H,2-12,16,21-23H2,1H3
InChIKey LLGHECFMWJPUGX-UHFFFAOYSA-N
Mol Weight 507.7 g/mol
Molecular Formula C30H41F4NO
Exact Mass 507.312428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5X2Az8rEAYm
Name 2-Fluoro-5-(trifluoromethyl)benzamide, N-(2-phenylethyl)-N-tetradecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 507.312427595 u
Formula C30H41F4NO
InChI InChI=1S/C30H41F4NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-22-35(23-21-25-17-14-13-15-18-25)29(36)27-24-26(30(32,33)34)19-20-28(27)31/h13-15,17-20,24H,2-12,16,21-23H2,1H3
InChIKey LLGHECFMWJPUGX-UHFFFAOYSA-N
Molecular Weight 507.658 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=C(C=CC1F)C(F)(F)F)CCCCCCCCCCCCCC