| SpectraBase Compound ID | 1CFWGtVP4lE |
|---|---|
| InChI | InChI=1S/C14H11IO/c1-10(16)12-8-5-9-13(14(12)15)11-6-3-2-4-7-11/h2-9H,1H3 |
| InChIKey | YCXNMMBPJANMEQ-UHFFFAOYSA-N |
| Mol Weight | 322.15 g/mol |
| Molecular Formula | C14H11IO |
| Exact Mass | 321.98546 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Lp4PnkhfTis |
|---|---|
| Name | 2-Iodo-3-phenylacetophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.985459973 u |
| Formula | C14H11IO |
| InChI | InChI=1S/C14H11IO/c1-10(16)12-8-5-9-13(14(12)15)11-6-3-2-4-7-11/h2-9H,1H3 |
| InChIKey | YCXNMMBPJANMEQ-UHFFFAOYSA-N |
| Molecular Weight | 322.145 g/mol |
| SMILES | C=1(C(C(=O)C)=CC=CC1C1=CC=CC=C1)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.888266 |