| SpectraBase Compound ID | GjO5ZtwFyBI |
|---|---|
| InChI | InChI=1S/C13H28S2/c1-3-5-7-8-9-10-11-13-15-14-12-6-4-2/h3-13H2,1-2H3 |
| InChIKey | HTPMLMWBKBOYHQ-UHFFFAOYSA-N |
| Mol Weight | 248.49 g/mol |
| Molecular Formula | C13H28S2 |
| Exact Mass | 248.163243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GIziX48eRJ1 |
|---|---|
| Name | Butyl nonyl disulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.163243250 u |
| Formula | C13H28S2 |
| InChI | InChI=1S/C13H28S2/c1-3-5-7-8-9-10-11-13-15-14-12-6-4-2/h3-13H2,1-2H3 |
| InChIKey | HTPMLMWBKBOYHQ-UHFFFAOYSA-N |
| Molecular Weight | 248.487 g/mol |
| SMILES | C(CCCCCCSSCCCC)CC |