| SpectraBase Compound ID | Gr7sOsrjsFA |
|---|---|
| InChI | InChI=1S/C6H10I2O2/c1-4(3-5(7)8)6(9)10-2/h4-5H,3H2,1-2H3 |
| InChIKey | NKIGXODOYDJSAN-UHFFFAOYSA-N |
| Mol Weight | 367.95 g/mol |
| Molecular Formula | C6H10I2O2 |
| Exact Mass | 367.87702 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ALRFJisHAxh |
|---|---|
| Name | Methyl 4,4-diiodo-2-methylbutanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.877019560 u |
| Formula | C6H10I2O2 |
| InChI | InChI=1S/C6H10I2O2/c1-4(3-5(7)8)6(9)10-2/h4-5H,3H2,1-2H3 |
| InChIKey | NKIGXODOYDJSAN-UHFFFAOYSA-N |
| Molecular Weight | 367.953 g/mol |
| SMILES | C(C(CC(I)I)C)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955467 |