| SpectraBase Compound ID | AufbgeWXYG1 |
|---|---|
| InChI | InChI=1S/C5H8OS/c1-4(6)3-5(2)7/h3,6H,1-2H3/b4-3- |
| InChIKey | IOBBRMMNXUURSJ-ARJAWSKDSA-N |
| Mol Weight | 116.18 g/mol |
| Molecular Formula | C5H8OS |
| Exact Mass | 116.029586 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GObRUbLz8MO |
|---|---|
| Name | 4-Hydroxy-3-pentene-2-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 116.029586051 u |
| Formula | C5H8OS |
| InChI | InChI=1S/C5H8OS/c1-4(6)3-5(2)7/h3,6H,1-2H3/b4-3- |
| InChIKey | IOBBRMMNXUURSJ-ARJAWSKDSA-N |
| Molecular Weight | 116.178 g/mol |
| Nominal Mass | 116 u |
| SMILES | C\C(=C\C(=S)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941913 |