| SpectraBase Compound ID | HP8KM7QdeZQ |
|---|---|
| InChI | InChI=1S/C12H9IO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H |
| InChIKey | BDKOUDYNKRCDEC-UHFFFAOYSA-N |
| Mol Weight | 296.11 g/mol |
| Molecular Formula | C12H9IO |
| Exact Mass | 295.96981 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LabEsSVFYY4 |
|---|---|
| Name | p-Iodophenyl phenyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.969809909 u |
| Formula | C12H9IO |
| InChI | InChI=1S/C12H9IO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H |
| InChIKey | BDKOUDYNKRCDEC-UHFFFAOYSA-N |
| Molecular Weight | 296.107 g/mol |
| SMILES | C1=C(C=CC=C1)OC1=CC=C(I)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940532 |