| SpectraBase Compound ID | 9d5hDTFjPGy |
|---|---|
| InChI | InChI=1S/C16H11ClN2O2/c17-13-14(19-10-7-5-9(18)6-8-10)16(21)12-4-2-1-3-11(12)15(13)20/h1-8,19H,18H2 |
| InChIKey | CUTJTJGOHDBQMN-UHFFFAOYSA-N |
| Mol Weight | 298.73 g/mol |
| Molecular Formula | C16H11ClN2O2 |
| Exact Mass | 298.050905 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 423cImSCx5Y |
|---|---|
| Name | 2-(4-Aminophenylamino)-3-chloro-1,4-naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.050905300 u |
| Formula | C16H11ClN2O2 |
| InChI | InChI=1S/C16H11ClN2O2/c17-13-14(19-10-7-5-9(18)6-8-10)16(21)12-4-2-1-3-11(12)15(13)20/h1-8,19H,18H2 |
| InChIKey | CUTJTJGOHDBQMN-UHFFFAOYSA-N |
| Molecular Weight | 298.729 g/mol |
| SMILES | C1=CC=C2C(=C1)C(C(=C(C2=O)NC1=CC=C(N)C=C1)Cl)=O |