| SpectraBase Compound ID | CbLNlxMDCLr |
|---|---|
| InChI | InChI=1S/C12H24O2/c1-4-7-11-10(6-3)9-13-12(14-11)8-5-2/h10-12H,4-9H2,1-3H3 |
| InChIKey | GSVCAIJJHANMAI-UHFFFAOYSA-N |
| Mol Weight | 200.32 g/mol |
| Molecular Formula | C12H24O2 |
| Exact Mass | 200.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7fpVMsGskrF |
|---|---|
| Name | 2,4-Dipropyl-5-ethyl-1,3-dioxane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.177630011 u |
| Formula | C12H24O2 |
| InChI | InChI=1S/C12H24O2/c1-4-7-11-10(6-3)9-13-12(14-11)8-5-2/h10-12H,4-9H2,1-3H3 |
| InChIKey | GSVCAIJJHANMAI-UHFFFAOYSA-N |
| Molecular Weight | 200.322 g/mol |
| SMILES | C1(COC(OC1CCC)CCC)CC |