| SpectraBase Compound ID | 6jzLiQv2laS |
|---|---|
| InChI | InChI=1S/C3H9O3PS/c1-4-7(8,5-2)6-3/h1-3H3 |
| InChIKey | XWSLYQXUTWUIKM-UHFFFAOYSA-N |
| Mol Weight | 156.14 g/mol |
| Molecular Formula | C3H9O3PS |
| Exact Mass | 156.001002 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FyNPMS20YRM |
|---|---|
| Name | Methyl phosphorothioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.001002319 u |
| Formula | C3H9O3PS |
| InChI | InChI=1S/C3H9O3PS/c1-4-7(8,5-2)6-3/h1-3H3 |
| InChIKey | XWSLYQXUTWUIKM-UHFFFAOYSA-N |
| Molecular Weight | 156.136 g/mol |
| SMILES | COP(=S)(OC)OC |