| SpectraBase Compound ID | AJPk62D7Fty |
|---|---|
| InChI | InChI=1S/C16H12O3/c1-9-7-12-13(8-14(9)19-2)16(18)11-6-4-3-5-10(11)15(12)17/h3-8H,1-2H3 |
| InChIKey | YJILUWQPXMLLTN-UHFFFAOYSA-N |
| Mol Weight | 252.27 g/mol |
| Molecular Formula | C16H12O3 |
| Exact Mass | 252.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7YnIrLIbVXS |
|---|---|
| Name | 2-Methoxy-3-methyl-9,10-anthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.078644243 u |
| Formula | C16H12O3 |
| InChI | InChI=1S/C16H12O3/c1-9-7-12-13(8-14(9)19-2)16(18)11-6-4-3-5-10(11)15(12)17/h3-8H,1-2H3 |
| InChIKey | YJILUWQPXMLLTN-UHFFFAOYSA-N |
| Molecular Weight | 252.269 g/mol |
| SMILES | C=12C(C(=O)C3=C(C2=O)C=CC=C3)=CC(=C(C1)C)OC |