![2-[2'-(1,3-Dioxolanyl)ethyl]2-[4''-(1,3-dioxolanyl)butyl]-1,3-dithiane](/api/spectrum/IZdjfdxensK/structure.png?h=300&w=458 "2-[2'-(1,3-Dioxolanyl)ethyl]2-[4''-(1,3-dioxolanyl)butyl]-1,3-dithiane")
| SpectraBase Compound ID | Ew8mDnyLF3W |
|---|---|
| InChI | InChI=1S/C16H28O4S2/c1(4-14-17-8-9-18-14)2-6-16(21-12-3-13-22-16)7-5-15-19-10-11-20-15/h14-15H,1-13H2 |
| InChIKey | LUELSLHIDIFUAX-UHFFFAOYSA-N |
| Mol Weight | 348.52 g/mol |
| Molecular Formula | C16H28O4S2 |
| Exact Mass | 348.142902 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IZdjfdxensK |
|---|---|
| Name | 2-[2'-(1,3-Dioxolanyl)ethyl]2-[4''-(1,3-dioxolanyl)butyl]-1,3-dithiane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.142901726 u |
| Formula | C16H28O4S2 |
| InChI | InChI=1S/C16H28O4S2/c1(4-14-17-8-9-18-14)2-6-16(21-12-3-13-22-16)7-5-15-19-10-11-20-15/h14-15H,1-13H2 |
| InChIKey | LUELSLHIDIFUAX-UHFFFAOYSA-N |
| Molecular Weight | 348.516 g/mol |
| SMILES | C1(SCCCS1)(CCC1OCCO1)CCCCC1OCCO1 |