| SpectraBase Compound ID | BxuQUF8DFBl |
|---|---|
| InChI | InChI=1S/C4H7IO2/c1-4(6)7-3-2-5/h2-3H2,1H3 |
| InChIKey | DYHCCCWROHIOFM-UHFFFAOYSA-N |
| Mol Weight | 214.0 g/mol |
| Molecular Formula | C4H7IO2 |
| Exact Mass | 213.949074 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HUyNZ06RSje |
|---|---|
| Name | .beta.-Iodoethyl acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.949074463 u |
| Formula | C4H7IO2 |
| InChI | InChI=1S/C4H7IO2/c1-4(6)7-3-2-5/h2-3H2,1H3 |
| InChIKey | DYHCCCWROHIOFM-UHFFFAOYSA-N |
| Molecular Weight | 214.002 g/mol |
| SMILES | C(I)COC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9714 |