| SpectraBase Spectrum ID |
GKjTTYhMWaJ |
| Name |
2-Propen-1-one, 1-(5-chloro-2-hydroxyphenyl)-3-(4-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
276.035335423 u |
| Formula |
C15H10ClFO2 |
| InChI |
InChI=1S/C15H10ClFO2/c16-11-4-8-15(19)13(9-11)14(18)7-3-10-1-5-12(17)6-2-10/h1-9,19H/b7-3+ |
| InChIKey |
LVBAJUXKSAGDDR-XVNBXDOJSA-N |
| Molecular Weight |
276.694 g/mol |
| SMILES |
OC1=CC=C(C=C1C(\C=C\C1=CC=C(C=C1)F)=O)Cl |
| Spectrum/Structure Validation Score (Raman) |
0.901198 |