| SpectraBase Compound ID | 8ryOXe74czX |
|---|---|
| InChI | InChI=1S/C11H10O4/c1-11(8-5-3-2-4-6-8)14-9(12)7-10(13)15-11/h2-6H,7H2,1H3 |
| InChIKey | QYBHZOTXTOEBRI-UHFFFAOYSA-N |
| Mol Weight | 206.2 g/mol |
| Molecular Formula | C11H10O4 |
| Exact Mass | 206.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 71dX1GRBQuz |
|---|---|
| Name | 1,3-Dioxane-4,6-dione, 2-methyl-2-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.057908798 u |
| Formula | C11H10O4 |
| InChI | InChI=1S/C11H10O4/c1-11(8-5-3-2-4-6-8)14-9(12)7-10(13)15-11/h2-6H,7H2,1H3 |
| InChIKey | QYBHZOTXTOEBRI-UHFFFAOYSA-N |
| Molecular Weight | 206.197 g/mol |
| SMILES | C1(OC(CC(O1)=O)=O)(C1=CC=CC=C1)C |