| SpectraBase Spectrum ID |
ICK1zqZbCOi |
| Name |
2-Iodo-1,3-diphenylpropane-1,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.980374592 u |
| Formula |
C15H11IO2 |
| InChI |
InChI=1S/C15H11IO2/c16-13(14(17)11-7-3-1-4-8-11)15(18)12-9-5-2-6-10-12/h1-10,13H |
| InChIKey |
ZJEGINPGDZFMNT-UHFFFAOYSA-N |
| Molecular Weight |
350.155 g/mol |
| SMILES |
C(C(C(=O)C=1C=CC=CC1)I)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851229 |
