| SpectraBase Compound ID | JXAXXaknh4d |
|---|---|
| InChI | InChI=1S/C6H2I2O2/c7-4-1-3(9)2-5(8)6(4)10/h1-2H |
| InChIKey | KANJSWOVFIVFDI-UHFFFAOYSA-N |
| Mol Weight | 359.89 g/mol |
| Molecular Formula | C6H2I2O2 |
| Exact Mass | 359.814419 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | F6nMTMDcjj4 |
|---|---|
| Name | 2,6-Diiodo-p-benzoquinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.814419302 u |
| Formula | C6H2I2O2 |
| InChI | InChI=1S/C6H2I2O2/c7-4-1-3(9)2-5(8)6(4)10/h1-2H |
| InChIKey | KANJSWOVFIVFDI-UHFFFAOYSA-N |
| Molecular Weight | 359.889 g/mol |
| SMILES | C1=C(C(C(=CC1=O)I)=O)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.922158 |