| SpectraBase Compound ID | 7sRlvLhVYx3 |
|---|---|
| InChI | InChI=1S/C21H13NO4/c23-19-14-9-4-5-10-15(14)20(24)18-16(19)11-6-12-17(18)22-21(25)26-13-7-2-1-3-8-13/h1-12H,(H,22,25) |
| InChIKey | IICSGNFDTBAOTG-UHFFFAOYSA-N |
| Mol Weight | 343.34 g/mol |
| Molecular Formula | C21H13NO4 |
| Exact Mass | 343.084458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | II87ON51xCl |
|---|---|
| Name | 1-Phenoxycarbonylaminoanthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.084457899 u |
| Formula | C21H13NO4 |
| InChI | InChI=1S/C21H13NO4/c23-19-14-9-4-5-10-15(14)20(24)18-16(19)11-6-12-17(18)22-21(25)26-13-7-2-1-3-8-13/h1-12H,(H,22,25) |
| InChIKey | IICSGNFDTBAOTG-UHFFFAOYSA-N |
| Molecular Weight | 343.338 g/mol |
| SMILES | C1=CC=C2C(=C1)C(C=1C(C2=O)=C(C=CC1)NC(=O)OC1=CC=CC=C1)=O |