| SpectraBase Compound ID | CV0Ql3wrfD2 |
|---|---|
| InChI | InChI=1S/C14H16O6/c1-9(18-10(2)15)13(19-11(3)16)8-7-12-5-4-6-14(17)20-12/h4-9,13H,1-3H3 |
| InChIKey | RVSJTKJIGRCTJI-UHFFFAOYSA-N |
| Mol Weight | 280.28 g/mol |
| Molecular Formula | C14H16O6 |
| Exact Mass | 280.094688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CQjxkDI45Pa |
|---|---|
| Name | 2H-Pyran-2-one, 6-(3,4-dihydroxy-1-penten-1-yl)-, diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.094688229 u |
| Formula | C14H16O6 |
| InChI | InChI=1S/C14H16O6/c1-9(18-10(2)15)13(19-11(3)16)8-7-12-5-4-6-14(17)20-12/h4-9,13H,1-3H3 |
| InChIKey | RVSJTKJIGRCTJI-UHFFFAOYSA-N |
| SMILES | C1=CC(OC(=C1)\C=C\C(C(C)OC(=O)C)OC(=O)C)=O |