| SpectraBase Spectrum ID |
3qhiWTZccRT |
| Name |
Benzamide, 3-trifluoromethyl-N-(2-butyl)-N-isobutyl- |
| 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/c1-5-12(4)20(10-11(2)3)15(21)13-7-6-8-14(9-13)16(17,18)19/h6-9,11-12H,5,10H2,1-4H3 |
| InChIKey |
SEZIFHBLUGTSBE-UHFFFAOYSA-N |
| Molecular Weight |
301.353 g/mol |
| SMILES |
C(=O)(N(CC(C)C)C(CC)C)C=1C=C(C=CC1)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844015 |
