| SpectraBase Compound ID | 4ajbG8hCIub |
|---|---|
| InChI | InChI=1S/C22H47NO3S2/c1-3-5-7-9-11-13-15-17-19-23(21-22-27-28(24,25)26)20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3,(H,24,25,26) |
| InChIKey | WZCCJYMBSRJLRR-UHFFFAOYSA-N |
| Mol Weight | 437.7 g/mol |
| Molecular Formula | C22H47NO3S2 |
| Exact Mass | 437.299737 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IHBHFsKgyP1 |
|---|---|
| Name | 2-Didecylaminoethanethiosulfuric acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 437.299736722 u |
| Formula | C22H47NO3S2 |
| InChI | InChI=1S/C22H47NO3S2/c1-3-5-7-9-11-13-15-17-19-23(21-22-27-28(24,25)26)20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3,(H,24,25,26) |
| InChIKey | WZCCJYMBSRJLRR-UHFFFAOYSA-N |
| Molecular Weight | 437.742 g/mol |
| SMILES | C(SS(O)(=O)=O)CN(CCCCCCCCCC)CCCCCCCCCC |