| SpectraBase Compound ID | GER6JH0amTD |
|---|---|
| InChI | InChI=1S/C3H3NO2S/c5-2-1-7-3(6)4-2/h1H2,(H,4,5,6) |
| InChIKey | ZOBPZXTWZATXDG-UHFFFAOYSA-N |
| Mol Weight | 117.12 g/mol |
| Molecular Formula | C3H3NO2S |
| Exact Mass | 116.98845 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JVy3W2kCbkA |
|---|---|
| Name | 2,4-Thiazolidinedione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 116.988449513 u |
| Formula | C3H3NO2S |
| InChI | InChI=1S/C3H3NO2S/c5-2-1-7-3(6)4-2/h1H2,(H,4,5,6) |
| InChIKey | ZOBPZXTWZATXDG-UHFFFAOYSA-N |
| SMILES | N1C(CSC1=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.986151 |