SpectraBase Spectrum ID |
8MHyqkWT51e |
Name |
3-Bromo-N-(3-fluorophenyl)benzamide, N-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
307.000805140 u |
Formula |
C14H11BrFNO |
InChI |
InChI=1S/C14H11BrFNO/c1-17(13-7-3-6-12(16)9-13)14(18)10-4-2-5-11(15)8-10/h2-9H,1H3 |
InChIKey |
BMAGRAPTWWXRHF-UHFFFAOYSA-N |
Molecular Weight |
308.150 g/mol |
SMILES |
C1(F)=CC(=CC=C1)N(C(=O)C1=CC(=CC=C1)Br)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88716 |