![1,3-Dithiane, 2-[2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethenyl]-, (E)-](/api/spectrum/3uyVdxRXlPK/structure.png?h=300&w=458 "1,3-Dithiane, 2-[2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethenyl]-, (E)-")
| SpectraBase Compound ID | GwGhPXYrVJa |
|---|---|
| InChI | InChI=1S/C15H24S2/c1-12-6-4-9-15(2,3)13(12)7-8-14-16-10-5-11-17-14/h6-8,13-14H,4-5,9-11H2,1-3H3/b8-7+ |
| InChIKey | PFERCJMLMFBKLY-BQYQJAHWSA-N |
| Mol Weight | 268.48 g/mol |
| Molecular Formula | C15H24S2 |
| Exact Mass | 268.131943 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3uyVdxRXlPK |
|---|---|
| Name | 1,3-Dithiane, 2-[2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethenyl]-, (E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.131943121 u |
| Formula | C15H24S2 |
| InChI | InChI=1S/C15H24S2/c1-12-6-4-9-15(2,3)13(12)7-8-14-16-10-5-11-17-14/h6-8,13-14H,4-5,9-11H2,1-3H3/b8-7+ |
| InChIKey | PFERCJMLMFBKLY-BQYQJAHWSA-N |
| SMILES | C1(\C=C\C2SCCCS2)C(=CCCC1(C)C)C |