| SpectraBase Compound ID | 38gNxR0UUEL |
|---|---|
| InChI | InChI=1S/C22H12O4/c23-19-13-7-3-4-8-14(13)20(24)18-17(19)21(25)15-9-11-5-1-2-6-12(11)10-16(15)22(18)26/h1-10,23-24H |
| InChIKey | HOJODHLBPDEBCR-UHFFFAOYSA-N |
| Mol Weight | 340.33 g/mol |
| Molecular Formula | C22H12O4 |
| Exact Mass | 340.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2sjCrCW0OyP |
|---|---|
| Name | 6,13-Pentacenedione, 5,14-dihydroxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.073558862 u |
| Formula | C22H12O4 |
| InChI | InChI=1S/C22H12O4/c23-19-13-7-3-4-8-14(13)20(24)18-17(19)21(25)15-9-11-5-1-2-6-12(11)10-16(15)22(18)26/h1-10,23-24H |
| InChIKey | HOJODHLBPDEBCR-UHFFFAOYSA-N |
| Molecular Weight | 340.334 g/mol |
| SMILES | C1(=O)C=2C(C(C3=C1C(O)=C1C=CC=CC1=C3O)=O)=CC=1C(=CC=CC1)C2 |