| SpectraBase Compound ID | FcEYlyM2eZj |
|---|---|
| InChI | InChI=1S/C36H72S6/c1-2-14-26-38-28-16-5-6-18-30-40-32-20-9-10-22-34-42-36-24-12-11-23-35-41-33-21-8-7-19-31-39-29-17-4-3-15-27-37-25-13-1/h1-36H2 |
| InChIKey | VEKZZDRDVLYXCI-UHFFFAOYSA-N |
| Mol Weight | 697.3 g/mol |
| Molecular Formula | C36H72S6 |
| Exact Mass | 696.395829 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EBJz0IRocYd |
|---|---|
| Name | 1,8,15,22,29,36-Hexathiacyclodotetracontane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 696.395829362 u |
| Formula | C36H72S6 |
| InChI | InChI=1S/C36H72S6/c1-2-14-26-38-28-16-5-6-18-30-40-32-20-9-10-22-34-42-36-24-12-11-23-35-41-33-21-8-7-19-31-39-29-17-4-3-15-27-37-25-13-1/h1-36H2 |
| InChIKey | VEKZZDRDVLYXCI-UHFFFAOYSA-N |
| SMILES | C1SCCCCCCSCCCCCCSCCCCCCSCCCCCCSCCCCCCSCCCCC1 |