| SpectraBase Compound ID | C12KYmfjel2 |
|---|---|
| InChI | InChI=1S/C12H26O10S2/c1-23(13,14)21-11-9-19-7-5-17-3-4-18-6-8-20-10-12-22-24(2,15)16/h3-12H2,1-2H3 |
| InChIKey | BGCFJPQXVQSYIS-UHFFFAOYSA-N |
| Mol Weight | 394.45 g/mol |
| Molecular Formula | C12H26O10S2 |
| Exact Mass | 394.096739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DaSucx8O8F5 |
|---|---|
| Name | 3,6,9,12-Tetraoxatetradecane-1,14-diol, 1,14-dimethanesulfonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 394.096739375 u |
| Formula | C12H26O10S2 |
| InChI | InChI=1S/C12H26O10S2/c1-23(13,14)21-11-9-19-7-5-17-3-4-18-6-8-20-10-12-22-24(2,15)16/h3-12H2,1-2H3 |
| InChIKey | BGCFJPQXVQSYIS-UHFFFAOYSA-N |
| Molecular Weight | 394.450 g/mol |
| SMILES | CS(OCCOCCOCCOCCOCCOS(C)(=O)=O)(=O)=O |