| SpectraBase Compound ID | DEDQuzSjgks |
|---|---|
| InChI | InChI=1S/C6H9IO2/c7-5-1-2-6(8)9-4-3-5/h5H,1-4H2/t5-/m0/s1 |
| InChIKey | RHOLVGXDSYBORP-YFKPBYRVSA-N |
| Mol Weight | 240.04 g/mol |
| Molecular Formula | C6H9IO2 |
| Exact Mass | 239.964725 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8mDs9Y2Qpxe |
|---|---|
| Name | C6 H9 I O2 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.964724528 u |
| Formula | C6H9IO2 |
| InChI | InChI=1S/C6H9IO2/c7-5-1-2-6(8)9-4-3-5/h5H,1-4H2/t5-/m0/s1 |
| InChIKey | RHOLVGXDSYBORP-YFKPBYRVSA-N |
| Molecular Weight | 240.040 g/mol |
| SMILES | C1(OCC[C@](CC1)(I)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981466 |