| SpectraBase Spectrum ID |
CmuHCLgcWc8 |
| Name |
Benzamide, 3-fluoro-4-trifluoromethyl-N-(2-butyl)-N-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.108976758 u |
| Formula |
C13H15F4NO |
| InChI |
InChI=1S/C13H15F4NO/c1-4-8(2)18(3)12(19)9-5-6-10(11(14)7-9)13(15,16)17/h5-8H,4H2,1-3H3 |
| InChIKey |
BROOJTKKBRZEEY-UHFFFAOYSA-N |
| Molecular Weight |
277.263 g/mol |
| SMILES |
CN(C(CC)C)C(=O)C=1C=C(C(=CC1)C(F)(F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856994 |
