| SpectraBase Compound ID | hQETxUzLHh |
|---|---|
| InChI | InChI=1S/C4H10O2S2/c1-3-4-7-8(2,5)6/h3-4H2,1-2H3 |
| InChIKey | NTHJPLSCKRFMSP-UHFFFAOYSA-N |
| Mol Weight | 154.24 g/mol |
| Molecular Formula | C4H10O2S2 |
| Exact Mass | 154.012222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JKXuq8XXFum |
|---|---|
| Name | S-Propylmethanethiosulfonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.012221908 u |
| Formula | C4H10O2S2 |
| InChI | InChI=1S/C4H10O2S2/c1-3-4-7-8(2,5)6/h3-4H2,1-2H3 |
| InChIKey | NTHJPLSCKRFMSP-UHFFFAOYSA-N |
| SMILES | CS(SCCC)(=O)=O |