| SpectraBase Compound ID | 4imfcFCXCI0 |
|---|---|
| InChI | InChI=1S/C14H30O4S4/c1-21(15,16)19-13-11-9-7-5-3-4-6-8-10-12-14-20-22(2,17)18/h3-14H2,1-2H3 |
| InChIKey | QAPZJGDWQBUOCV-UHFFFAOYSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C14H30O4S4 |
| Exact Mass | 390.102694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L7dUe25H8z2 |
|---|---|
| Name | Methanesulfonothioic acid 1,12-dodecanediyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 390.102694138 u |
| Formula | C14H30O4S4 |
| InChI | InChI=1S/C14H30O4S4/c1-21(15,16)19-13-11-9-7-5-3-4-6-8-10-12-14-20-22(2,17)18/h3-14H2,1-2H3 |
| InChIKey | QAPZJGDWQBUOCV-UHFFFAOYSA-N |
| Molecular Weight | 390.630 g/mol |
| SMILES | CS(=O)(=O)SCCCCCCCCCCCCSS(=O)(=O)C |