| SpectraBase Compound ID | FYRCeYuBPEV |
|---|---|
| InChI | InChI=1S/C17H14O5/c1-21-12-5-3-4-10-13(12)16(20)14-11(15(10)19)7-6-9(8-18)17(14)22-2/h3-7,18H,8H2,1-2H3 |
| InChIKey | OMYVIQRWDDTEBK-UHFFFAOYSA-N |
| Mol Weight | 298.29 g/mol |
| Molecular Formula | C17H14O5 |
| Exact Mass | 298.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CCEleBSavhZ |
|---|---|
| Name | 9,10-Anthracenedione, 2-(hydroxymethyl)-1,8-dimethoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.084123546 u |
| Formula | C17H14O5 |
| InChI | InChI=1S/C17H14O5/c1-21-12-5-3-4-10-13(12)16(20)14-11(15(10)19)7-6-9(8-18)17(14)22-2/h3-7,18H,8H2,1-2H3 |
| InChIKey | OMYVIQRWDDTEBK-UHFFFAOYSA-N |
| Molecular Weight | 298.294 g/mol |
| SMILES | C12=C(C(C=3C(C2=O)=CC=C(C3OC)CO)=O)C(=CC=C1)OC |