| SpectraBase Spectrum ID |
F09uxVEcZB5 |
| Name |
1-(3,4-Difluorophenyl)-3-(4-fluorophenyl)prop-2-en-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.060549398 u |
| Formula |
C15H9F3O |
| InChI |
InChI=1S/C15H9F3O/c16-12-5-1-10(2-6-12)3-8-15(19)11-4-7-13(17)14(18)9-11/h1-9H/b8-3+ |
| InChIKey |
FOTHQDQMXHPTOK-FPYGCLRLSA-N |
| Molecular Weight |
262.231 g/mol |
| SMILES |
C1(\C=C\C(C=2C=C(C(=CC2)F)F)=O)=CC=C(C=C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936167 |