| SpectraBase Spectrum ID |
3WhfLWpRsqS |
| Name |
6-Bromo-2-(2-fluorophenyl)chromen-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.969170659 u |
| Formula |
C15H8BrFO2 |
| InChI |
InChI=1S/C15H8BrFO2/c16-9-5-6-14-11(7-9)13(18)8-15(19-14)10-3-1-2-4-12(10)17/h1-8H |
| InChIKey |
DAYQXLQRTQODQF-UHFFFAOYSA-N |
| Molecular Weight |
319.129 g/mol |
| SMILES |
C1(=CC(C=2C(O1)=CC=C(C2)Br)=O)C=1C(F)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909592 |