| SpectraBase Compound ID | GZQxcfMna4H |
|---|---|
| InChI | InChI=1S/C9H13O3PS/c1-8-5-4-6-9(7-8)12-13(14,10-2)11-3/h4-7H,1-3H3 |
| InChIKey | YFQPMEGCEGLMSS-UHFFFAOYSA-N |
| Mol Weight | 232.23 g/mol |
| Molecular Formula | C9H13O3PS |
| Exact Mass | 232.032302 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1DJvGAJDVBu |
|---|---|
| Name | Phosphorothioic acid, o,o-dimethyl o-m-tolyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.032302448 u |
| Formula | C9H13O3PS |
| InChI | InChI=1S/C9H13O3PS/c1-8-5-4-6-9(7-8)12-13(14,10-2)11-3/h4-7H,1-3H3 |
| InChIKey | YFQPMEGCEGLMSS-UHFFFAOYSA-N |
| Molecular Weight | 232.234 g/mol |
| SMILES | C=1C(=CC(=CC1)OP(=S)(OC)OC)C |