| SpectraBase Spectrum ID |
3buIOF55Yl2 |
| Name |
Propenone, 1-(benzo[B]-1,4-dioxane-6-yl)-3-(4-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.084872439 u |
| Formula |
C17H13FO3 |
| InChI |
InChI=1S/C17H13FO3/c18-14-5-1-12(2-6-14)3-7-15(19)13-4-8-16-17(11-13)21-10-9-20-16/h1-8,11H,9-10H2/b7-3+ |
| InChIKey |
IAXCNIQXUZSRMN-XVNBXDOJSA-N |
| Molecular Weight |
284.286 g/mol |
| SMILES |
C(\C=C\C=1C=CC(=CC1)F)(C=1C=C2OCCOC2=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886869 |
![Propenone, 1-(benzo[b]-1,4-dioxane-6-yl)-3-(4-fluorophenyl)-](/api/spectrum/3buIOF55Yl2/structure.png?h=300&w=458 "Propenone, 1-(benzo[b]-1,4-dioxane-6-yl)-3-(4-fluorophenyl)-")
