| SpectraBase Compound ID | CMjz8o5R33t |
|---|---|
| InChI | InChI=1S/C4H6O2S/c5-4-3(7)1-2-6-4/h3,7H,1-2H2 |
| InChIKey | SUWCVSZZLFOSJL-UHFFFAOYSA-N |
| Mol Weight | 118.15 g/mol |
| Molecular Formula | C4H6O2S |
| Exact Mass | 118.008851 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5yzpUj1WsZO |
|---|---|
| Name | 4-Hydroxy-2-mercaptobutyric acid, gamma-lactone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 118.008850605 u |
| Formula | C4H6O2S |
| InChI | InChI=1S/C4H6O2S/c5-4-3(7)1-2-6-4/h3,7H,1-2H2 |
| InChIKey | SUWCVSZZLFOSJL-UHFFFAOYSA-N |
| Molecular Weight | 118.150 g/mol |
| SMILES | SC1C(OCC1)=O |
| Spectrum/Structure Validation Score (Raman) | 0.805927 |