| SpectraBase Spectrum ID |
4nciJetbKl4 |
| Name |
Benzamide, 4-trifluoromethyl-N-(2-pentyl)-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.227949078 u |
| Formula |
C20H30F3NO |
| InChI |
InChI=1S/C20H30F3NO/c1-4-6-7-8-9-15-24(16(3)10-5-2)19(25)17-11-13-18(14-12-17)20(21,22)23/h11-14,16H,4-10,15H2,1-3H3 |
| InChIKey |
FNXUJDPCVLTHBA-UHFFFAOYSA-N |
| Molecular Weight |
357.461 g/mol |
| SMILES |
C(C1=CC=C(C=C1)C(F)(F)F)(=O)N(CCCCCCC)C(CCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.84222 |
