| SpectraBase Spectrum ID |
CCJShWRvrdP |
| Name |
6-Chloro-2-(3-fluoro-phenyl)-chromen-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.019685359 u |
| Formula |
C15H8ClFO2 |
| InChI |
InChI=1S/C15H8ClFO2/c16-10-4-5-14-12(7-10)13(18)8-15(19-14)9-2-1-3-11(17)6-9/h1-8H |
| InChIKey |
GQXSRHIFUJLCSW-UHFFFAOYSA-N |
| Molecular Weight |
274.678 g/mol |
| SMILES |
C1(=CC(C=2C(O1)=CC=C(C2)Cl)=O)C=1C=C(C=CC1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918749 |
