| SpectraBase Compound ID | JY9btn7ZulC |
|---|---|
| InChI | InChI=1S/C6H8I2/c7-5-3-1-2-4-6-8/h1,3,5-6H2 |
| InChIKey | VIMPHXWBTBYZJJ-UHFFFAOYSA-N |
| Mol Weight | 333.94 g/mol |
| Molecular Formula | C6H8I2 |
| Exact Mass | 333.87154 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4qDpY6XrI0P |
|---|---|
| Name | 1,6-Diiodo-2-hexyne |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.871540258 u |
| Formula | C6H8I2 |
| InChI | InChI=1S/C6H8I2/c7-5-3-1-2-4-6-8/h1,3,5-6H2 |
| InChIKey | VIMPHXWBTBYZJJ-UHFFFAOYSA-N |
| Molecular Weight | 333.939 g/mol |
| SMILES | C(#CCCCI)CI |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948788 |