| SpectraBase Compound ID | JeBLD1Nxut1 |
|---|---|
| InChI | InChI=1S/C12H22O6/c1-5-15-11(16-6-2)7-8-12(17-9(3)13)18-10(4)14/h11-12H,5-8H2,1-4H3 |
| InChIKey | LXVLSSWQJAJSIR-UHFFFAOYSA-N |
| Mol Weight | 262.3 g/mol |
| Molecular Formula | C12H22O6 |
| Exact Mass | 262.141638 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ECVmYjVLrpq |
|---|---|
| Name | 4,4-Diacetoxybutyral dehyde diethyl acetal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.141638422 u |
| Formula | C12H22O6 |
| InChI | InChI=1S/C12H22O6/c1-5-15-11(16-6-2)7-8-12(17-9(3)13)18-10(4)14/h11-12H,5-8H2,1-4H3 |
| InChIKey | LXVLSSWQJAJSIR-UHFFFAOYSA-N |
| Molecular Weight | 262.302 g/mol |
| SMILES | C(CCC(OC(=O)C)OC(=O)C)(OCC)OCC |