SpectraBase Spectrum ID |
2zagAcqz03E |
Name |
2-(p-Fluorophenyl)-6-fluoro-3-bromoflavone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
335.959748789 u |
Formula |
C15H7BrF2O2 |
InChI |
InChI=1S/C15H7BrF2O2/c16-13-14(19)11-7-10(18)5-6-12(11)20-15(13)8-1-3-9(17)4-2-8/h1-7H |
InChIKey |
YNTQINDHFACOEX-UHFFFAOYSA-N |
Molecular Weight |
337.120 g/mol |
SMILES |
C1(=C(OC=2C(C1=O)=CC(=CC2)F)C1=CC=C(C=C1)F)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915927 |