![2-(4'-Pentenyl)-2-[3''-(1,3-dioxolanyl)propyl]-1,3-dithiane](/api/spectrum/JYVH0vb6UBS/structure.png?h=300&w=458 "2-(4'-Pentenyl)-2-[3''-(1,3-dioxolanyl)propyl]-1,3-dithiane")
| SpectraBase Compound ID | LR45sIxCzKd |
|---|---|
| InChI | InChI=1S/C15H26O2S2/c1-2-3-4-8-15(18-12-6-13-19-15)9-5-7-14-16-10-11-17-14/h2,14H,1,3-13H2 |
| InChIKey | BCHWDZONUORDPU-UHFFFAOYSA-N |
| Mol Weight | 302.49 g/mol |
| Molecular Formula | C15H26O2S2 |
| Exact Mass | 302.137422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JYVH0vb6UBS |
|---|---|
| Name | 2-(4'-Pentenyl)-2-[3''-(1,3-dioxolanyl)propyl]-1,3-dithiane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.137422423 u |
| Formula | C15H26O2S2 |
| InChI | InChI=1S/C15H26O2S2/c1-2-3-4-8-15(18-12-6-13-19-15)9-5-7-14-16-10-11-17-14/h2,14H,1,3-13H2 |
| InChIKey | BCHWDZONUORDPU-UHFFFAOYSA-N |
| Molecular Weight | 302.491 g/mol |
| SMILES | C1(SCCCS1)(CCCC1OCCO1)CCCC=C |