SpectraBase Spectrum ID |
3hSBdezEqJW |
Name |
Benzamide, 2-fluoro-5-trifluoromethyl-N-benzyl-N-octadecyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
549.359377788 u |
Formula |
C33H47F4NO |
InChI |
InChI=1S/C33H47F4NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-38(27-28-21-18-17-19-22-28)32(39)30-26-29(33(35,36)37)23-24-31(30)34/h17-19,21-24,26H,2-16,20,25,27H2,1H3 |
InChIKey |
USQVCSLFHDWUJB-UHFFFAOYSA-N |
Molecular Weight |
549.739 g/mol |
SMILES |
C1=C(C=CC(=C1C(N(CCCCCCCCCCCCCCCCCC)CC1=CC=CC=C1)=O)F)C(F)(F)F |