| SpectraBase Compound ID | 1bENlQyN1JQ |
|---|---|
| InChI | InChI=1S/C21H14O4/c1-24-13-6-4-7-14(12-13)25-18-11-5-10-17-19(18)21(23)16-9-3-2-8-15(16)20(17)22/h2-12H,1H3 |
| InChIKey | IRCISKWSDVQUDB-UHFFFAOYSA-N |
| Mol Weight | 330.34 g/mol |
| Molecular Formula | C21H14O4 |
| Exact Mass | 330.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3pnVveCYhq5 |
|---|---|
| Name | 1-(m-Methoxyphenoxy)anthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.089208927 u |
| Formula | C21H14O4 |
| InChI | InChI=1S/C21H14O4/c1-24-13-6-4-7-14(12-13)25-18-11-5-10-17-19(18)21(23)16-9-3-2-8-15(16)20(17)22/h2-12H,1H3 |
| InChIKey | IRCISKWSDVQUDB-UHFFFAOYSA-N |
| Molecular Weight | 330.339 g/mol |
| SMILES | C=12C(=CC=CC1C(C=1C=CC=CC1C2=O)=O)OC=1C=CC=C(C1)OC |