| SpectraBase Spectrum ID |
A7xaSTAZww |
| Name |
Benzamide, 4-(trifluoromethyl)-N-butyl-N-hept-2-yl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.212299014 u |
| Formula |
C19H28F3NO |
| InChI |
InChI=1S/C19H28F3NO/c1-4-6-8-9-15(3)23(14-7-5-2)18(24)16-10-12-17(13-11-16)19(20,21)22/h10-13,15H,4-9,14H2,1-3H3 |
| InChIKey |
FYPPAPFNRZXRHX-UHFFFAOYSA-N |
| Molecular Weight |
343.434 g/mol |
| SMILES |
C1=CC(=CC=C1C(N(CCCC)C(CCCCC)C)=O)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933298 |
