| SpectraBase Compound ID | 91MMfkStNi |
|---|---|
| InChI | InChI=1S/C20H11BrO2/c21-13-10-8-12(9-11-13)14-6-3-7-17-18(14)20(23)16-5-2-1-4-15(16)19(17)22/h1-11H |
| InChIKey | BRVNSUWHDIWCGQ-UHFFFAOYSA-N |
| Mol Weight | 363.21 g/mol |
| Molecular Formula | C20H11BrO2 |
| Exact Mass | 361.994243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | fzVL7hlAJQ |
|---|---|
| Name | Anthraquinone, 1-(p-bromophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 361.994242592 u |
| Formula | C20H11BrO2 |
| InChI | InChI=1S/C20H11BrO2/c21-13-10-8-12(9-11-13)14-6-3-7-17-18(14)20(23)16-5-2-1-4-15(16)19(17)22/h1-11H |
| InChIKey | BRVNSUWHDIWCGQ-UHFFFAOYSA-N |
| Molecular Weight | 363.210 g/mol |
| SMILES | C1(=O)C2=C(C=CC=C2C(C2=C1C=CC=C2)=O)C1=CC=C(C=C1)Br |