| SpectraBase Spectrum ID |
Ej87cdlLufu |
| Name |
4-Hydroxy-3-[1-iodo-(Z)-methylidene]-6-phenyl-(E)-5-hexen-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.996024657 u |
| Formula |
C13H13IO2 |
| InChI |
InChI=1S/C13H13IO2/c1-10(15)12(9-14)13(16)8-7-11-5-3-2-4-6-11/h2-9,13,16H,1H3/b8-7+,12-9+ |
| InChIKey |
ONSUUJFSGLTCOJ-ANKZSMJWSA-N |
| Molecular Weight |
328.149 g/mol |
| SMILES |
C(\C(C(\C=C\C1=CC=CC=C1)O)=C/I)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965175 |
![4-Hydroxy-3-[1-iodo-(Z)-methylidene]-6-phenyl-(E)-5-hexen-2-one](/api/spectrum/Ej87cdlLufu/structure.png?h=300&w=458 "4-Hydroxy-3-[1-iodo-(Z)-methylidene]-6-phenyl-(E)-5-hexen-2-one")
