SpectraBase Spectrum ID |
7hInXTUccPP |
Name |
2,6-Difluoro-3-methylbenzamide, N-(4-bromophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
324.991383271 u |
Formula |
C14H10BrF2NO |
InChI |
InChI=1S/C14H10BrF2NO/c1-8-2-7-11(16)12(13(8)17)14(19)18-10-5-3-9(15)4-6-10/h2-7H,1H3,(H,18,19) |
InChIKey |
PDDRMXCGVINYRF-UHFFFAOYSA-N |
Molecular Weight |
326.141 g/mol |
SMILES |
C1(=CC=C(C=C1)NC(C1=C(C(=CC=C1F)C)F)=O)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939972 |