SpectraBase Spectrum ID |
GhEIWIkko3u |
Name |
Benzamide, N-(4-fluorophenyl)-4-bromo- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.985155076 u |
Formula |
C13H9BrFNO |
InChI |
InChI=1S/C13H9BrFNO/c14-10-3-1-9(2-4-10)13(17)16-12-7-5-11(15)6-8-12/h1-8H,(H,16,17) |
InChIKey |
DBCKBDOQSKIIOA-UHFFFAOYSA-N |
Molecular Weight |
294.123 g/mol |
SMILES |
C1=C(C=CC(=C1)C(NC1=CC=C(C=C1)F)=O)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95762 |