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Benzamide, 4-trifluoromethyl-N-benzyl-N-octadecyl-

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Benzamide, 4-trifluoromethyl-N-benzyl-N-octadecyl-
SpectraBase Compound ID Hm3ImnOqO8B
InChI InChI=1S/C33H48F3NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27-37(28-29-21-18-17-19-22-29)32(38)30-23-25-31(26-24-30)33(34,35)36/h17-19,21-26H,2-16,20,27-28H2,1H3
InChIKey AKCCILHUXBHDTB-UHFFFAOYSA-N
Mol Weight 531.7 g/mol
Molecular Formula C33H48F3NO
Exact Mass 531.3688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5gB5jmnIl87
Name Benzamide, 4-trifluoromethyl-N-benzyl-N-octadecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 531.368799658 u
Formula C33H48F3NO
InChI InChI=1S/C33H48F3NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27-37(28-29-21-18-17-19-22-29)32(38)30-23-25-31(26-24-30)33(34,35)36/h17-19,21-26H,2-16,20,27-28H2,1H3
InChIKey AKCCILHUXBHDTB-UHFFFAOYSA-N
Molecular Weight 531.748 g/mol
SMILES C1=CC(=CC=C1C(N(CCCCCCCCCCCCCCCCCC)CC1=CC=CC=C1)=O)C(F)(F)F