| SpectraBase Spectrum ID |
HInbKzozW2j |
| Name |
Benzamide, 3-fluoro-5-trifluoromethyl-N-ethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.062026565 u |
| Formula |
C10H9F4NO |
| InChI |
InChI=1S/C10H9F4NO/c1-2-15-9(16)6-3-7(10(12,13)14)5-8(11)4-6/h3-5H,2H2,1H3,(H,15,16) |
| InChIKey |
FJNKHCIDBFWKMA-UHFFFAOYSA-N |
| Molecular Weight |
235.182 g/mol |
| SMILES |
C(NCC)(=O)C=1C=C(C=C(F)C1)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873082 |
