| SpectraBase Spectrum ID |
AnBEA3vwQGb |
| Name |
Benzamide, 3-fluoro-4-trifluoromethyl-N-benzyl-N-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.093326694 u |
| Formula |
C16H13F4NO |
| InChI |
InChI=1S/C16H13F4NO/c1-21(10-11-5-3-2-4-6-11)15(22)12-7-8-13(14(17)9-12)16(18,19)20/h2-9H,10H2,1H3 |
| InChIKey |
CBBVIHWWPQNRNR-UHFFFAOYSA-N |
| Molecular Weight |
311.280 g/mol |
| SMILES |
C(N(C)CC1=CC=CC=C1)(=O)C=1C=C(C(=CC1)C(F)(F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892951 |
