| SpectraBase Compound ID | 7oMgwjjFORd |
|---|---|
| InChI | InChI=1S/C18H14O4/c1-3-4-10-5-7-13-15(16(10)19)18(21)14-9-11(22-2)6-8-12(14)17(13)20/h3,5-9,19H,1,4H2,2H3 |
| InChIKey | XNVHLCPGOUUTKT-UHFFFAOYSA-N |
| Mol Weight | 294.31 g/mol |
| Molecular Formula | C18H14O4 |
| Exact Mass | 294.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCb8oqOIjq |
|---|---|
| Name | 1-Hydroxy-8-methoxy-2-(prop-2'-enyl)anthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.089208927 u |
| Formula | C18H14O4 |
| InChI | InChI=1S/C18H14O4/c1-3-4-10-5-7-13-15(16(10)19)18(21)14-9-11(22-2)6-8-12(14)17(13)20/h3,5-9,19H,1,4H2,2H3 |
| InChIKey | XNVHLCPGOUUTKT-UHFFFAOYSA-N |
| Molecular Weight | 294.306 g/mol |
| SMILES | C1=2C(C=3C(=CC=C(C3)OC)C(C1=CC=C(C2O)CC=C)=O)=O |