| SpectraBase Compound ID | JczTwl4fVh9 |
|---|---|
| InChI | InChI=1S/C10H20O5/c1-4-14-10(15-5-2)9(13)6-8(12)7(3)11/h7,9-11,13H,4-6H2,1-3H3 |
| InChIKey | WGCGPKPAUYYAEC-UHFFFAOYSA-N |
| Mol Weight | 220.26 g/mol |
| Molecular Formula | C10H20O5 |
| Exact Mass | 220.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7S9R2QziufI |
|---|---|
| Name | 6,6-Diethoxy-2,5-dihydroxyhexan-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.131073739 u |
| Formula | C10H20O5 |
| InChI | InChI=1S/C10H20O5/c1-4-14-10(15-5-2)9(13)6-8(12)7(3)11/h7,9-11,13H,4-6H2,1-3H3 |
| InChIKey | WGCGPKPAUYYAEC-UHFFFAOYSA-N |
| Molecular Weight | 220.265 g/mol |
| SMILES | CC(C(CC(C(OCC)OCC)O)=O)O |