| SpectraBase Compound ID | 9DX4ucmo1mi |
|---|---|
| InChI | InChI=1S/C5H11NS/c1-5(2)6-3-4-7-5/h6H,3-4H2,1-2H3 |
| InChIKey | SNPQRYOQWLOTFA-UHFFFAOYSA-N |
| Mol Weight | 117.21 g/mol |
| Molecular Formula | C5H11NS |
| Exact Mass | 117.061221 g/mol |
| SpectraBase Spectrum ID | KhxtkNBOdfu |
|---|---|
| Name | 2,2-Dimethylthiazolidine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 117.061220532 u |
| Formula | C5H11NS |
| InChI | InChI=1S/C5H11NS/c1-5(2)6-3-4-7-5/h6H,3-4H2,1-2H3 |
| InChIKey | SNPQRYOQWLOTFA-UHFFFAOYSA-N |
| Molecular Weight | 117.210 g/mol |
| SMILES | C1NC(SC1)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.906124 |