| SpectraBase Spectrum ID |
3LyAaRRtOBb |
| Name |
Benzamide, N-(3-methylphenyl)-2,6-difluoro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.080870303 u |
| Formula |
C14H11F2NO |
| InChI |
InChI=1S/C14H11F2NO/c1-9-4-2-5-10(8-9)17-14(18)13-11(15)6-3-7-12(13)16/h2-8H,1H3,(H,17,18) |
| InChIKey |
GLJNSSJUIBRIQJ-UHFFFAOYSA-N |
| Molecular Weight |
247.245 g/mol |
| SMILES |
C1=CC=C(C(=C1F)C(NC1=CC(C)=CC=C1)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896924 |
