| SpectraBase Compound ID | 7WSpfiXZlJ8 |
|---|---|
| InChI | InChI=1S/C14H12O6/c1-6(15)10-13(17)11-8(12(16)14(10)18)4-7(19-2)5-9(11)20-3/h4-5,18H,1-3H3 |
| InChIKey | SQVQWVOQAJIUFG-UHFFFAOYSA-N |
| Mol Weight | 276.24 g/mol |
| Molecular Formula | C14H12O6 |
| Exact Mass | 276.063388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9KYYhjyzHff |
|---|---|
| Name | 1,4-Naphthalenedione, 3-acetyl-2-hydroxy-5,7-dimethoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.063388100 u |
| Formula | C14H12O6 |
| InChI | InChI=1S/C14H12O6/c1-6(15)10-13(17)11-8(12(16)14(10)18)4-7(19-2)5-9(11)20-3/h4-5,18H,1-3H3 |
| InChIKey | SQVQWVOQAJIUFG-UHFFFAOYSA-N |
| Molecular Weight | 276.244 g/mol |
| SMILES | C1(=C(C(=O)C2=C(C1=O)C(=CC(OC)=C2)OC)O)C(=O)C |