| SpectraBase Spectrum ID |
2nMUDLlCBi0 |
| Name |
Benzamide, 2-trifluoromethyl-N-(2-pentyl)-N-propyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.165348820 u |
| Formula |
C16H22F3NO |
| InChI |
InChI=1S/C16H22F3NO/c1-4-8-12(3)20(11-5-2)15(21)13-9-6-7-10-14(13)16(17,18)19/h6-7,9-10,12H,4-5,8,11H2,1-3H3 |
| InChIKey |
ONCKDVTZXQNKHP-UHFFFAOYSA-N |
| Molecular Weight |
301.353 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C=1C(C(F)(F)F)=CC=CC1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.84879 |
