| SpectraBase Compound ID | GzyT31iFr1k |
|---|---|
| InChI | InChI=1S/C10H18O4S/c1-7(2)13-9(11)5-15-6-10(12)14-8(3)4/h7-8H,5-6H2,1-4H3 |
| InChIKey | MWKRETCQQBSARE-UHFFFAOYSA-N |
| Mol Weight | 234.31 g/mol |
| Molecular Formula | C10H18O4S |
| Exact Mass | 234.09258 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lbsflvi9bXc |
|---|---|
| Name | Diisopropyl thiodiglycolate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.092580230 u |
| Formula | C10H18O4S |
| InChI | InChI=1S/C10H18O4S/c1-7(2)13-9(11)5-15-6-10(12)14-8(3)4/h7-8H,5-6H2,1-4H3 |
| InChIKey | MWKRETCQQBSARE-UHFFFAOYSA-N |
| Molecular Weight | 234.310 g/mol |
| SMILES | C(=O)(OC(C)C)CSCC(OC(C)C)=O |