![Dimethyl [(methylthio)methyl]phosphonate](/api/spectrum/8qwXsYSZbrr/structure.png?h=300&w=458 "Dimethyl [(methylthio)methyl]phosphonate")
| SpectraBase Compound ID | 2f2CxvJRQdp |
|---|---|
| InChI | InChI=1S/C4H11O3PS/c1-6-8(5,7-2)4-9-3/h4H2,1-3H3 |
| InChIKey | YAXJGKZVDZMBSX-UHFFFAOYSA-N |
| Mol Weight | 170.16 g/mol |
| Molecular Formula | C4H11O3PS |
| Exact Mass | 170.016652 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8qwXsYSZbrr |
|---|---|
| Name | Dimethyl [(methylthio)methyl]phosphonate; phosphonic acid, [(methylthio)methyl]-, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.016652383 u |
| Formula | C4H11O3PS |
| InChI | InChI=1S/C4H11O3PS/c1-6-8(5,7-2)4-9-3/h4H2,1-3H3 |
| InChIKey | YAXJGKZVDZMBSX-UHFFFAOYSA-N |
| Molecular Weight | 170.163 g/mol |
| SMILES | C(P(OC)(=O)OC)SC |