| SpectraBase Compound ID | 4kXA4Rp3Nsm |
|---|---|
| InChI | InChI=1S/C16H12O4/c1-8-6-11(17)14-10(15(8)18)7-9-4-3-5-12(20-2)13(9)16(14)19/h3-7,19H,1-2H3 |
| InChIKey | XSABGPZKVKDKCH-UHFFFAOYSA-N |
| Mol Weight | 268.27 g/mol |
| Molecular Formula | C16H12O4 |
| Exact Mass | 268.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7LPeBHs5YpU |
|---|---|
| Name | 10-Hydroxy-5-methoxy-2-methyl-1,4-anthracenedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.073558862 u |
| Formula | C16H12O4 |
| InChI | InChI=1S/C16H12O4/c1-8-6-11(17)14-10(15(8)18)7-9-4-3-5-12(20-2)13(9)16(14)19/h3-7,19H,1-2H3 |
| InChIKey | XSABGPZKVKDKCH-UHFFFAOYSA-N |
| SMILES | C1=CC=C2C(=C1OC)C(=C1C(=C2)C(C(=CC1=O)C)=O)O |