| SpectraBase Compound ID | LufaffmDLUo |
|---|---|
| InChI | InChI=1S/C17H13NO3/c1-21-12-8-6-11(7-9-12)18-15-10-16(19)13-4-2-3-5-14(13)17(15)20/h2-10,18H,1H3 |
| InChIKey | VHJMLDQPIJTWAU-UHFFFAOYSA-N |
| Mol Weight | 279.29 g/mol |
| Molecular Formula | C17H13NO3 |
| Exact Mass | 279.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KBBQFJDWCi3 |
|---|---|
| Name | 2-(4-Methoxyanilino)naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.089543280 u |
| Formula | C17H13NO3 |
| InChI | InChI=1S/C17H13NO3/c1-21-12-8-6-11(7-9-12)18-15-10-16(19)13-4-2-3-5-14(13)17(15)20/h2-10,18H,1H3 |
| InChIKey | VHJMLDQPIJTWAU-UHFFFAOYSA-N |
| Molecular Weight | 279.295 g/mol |
| SMILES | C1(NC2=CC(=O)C3=C(C2=O)C=CC=C3)=CC=C(C=C1)OC |