![2-[(2S,4S)-2,4-dimethyloctyl]-1,3-dithiane](/api/spectrum/B3S1XpNT9Da/structure.png?h=300&w=458 "2-[(2S,4S)-2,4-dimethyloctyl]-1,3-dithiane")
| SpectraBase Compound ID | LXb6tWMIlcj |
|---|---|
| InChI | InChI=1S/C14H28S2/c1-4-5-7-12(2)10-13(3)11-14-15-8-6-9-16-14/h12-14H,4-11H2,1-3H3/t12-,13-/m0/s1 |
| InChIKey | FFBXMAVQAUCINL-STQMWFEESA-N |
| Mol Weight | 260.5 g/mol |
| Molecular Formula | C14H28S2 |
| Exact Mass | 260.163243 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B3S1XpNT9Da |
|---|---|
| Name | 2-[(2S,4S)-2,4-dimethyloctyl]-1,3-dithiane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H28S2 |
| InChI | InChI=1S/C14H28S2/c1-4-5-7-12(2)10-13(3)11-14-15-8-6-9-16-14/h12-14H,4-11H2,1-3H3/t12-,13-/m0/s1 |
| InChIKey | FFBXMAVQAUCINL-STQMWFEESA-N |
| Molecular Weight | 260.498 g/mol |
| SMILES | C1(SCCCS1)C[C@](C[C@](CCCC)(C)[H])(C)[H] |
| SPLASH | splash10-03di-0690000000-b898ede810236833903b |
| Source of Spectrum | SO-0-1866-7 |
| Wiley ID | 878227 |