| SpectraBase Compound ID | 9F0jpmucmjX |
|---|---|
| InChI | InChI=1S/C16H9Cl2NO2/c17-9-5-7-10(8-6-9)19-14-13(18)15(20)11-3-1-2-4-12(11)16(14)21/h1-8,19H |
| InChIKey | LBKUWRCJEFJUNW-UHFFFAOYSA-N |
| Mol Weight | 318.16 g/mol |
| Molecular Formula | C16H9Cl2NO2 |
| Exact Mass | 317.001034 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FhnLbYSV4g9 |
|---|---|
| Name | 2-Chloro-3-(4-chloroanilino)naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.001033932 u |
| Formula | C16H9Cl2NO2 |
| InChI | InChI=1S/C16H9Cl2NO2/c17-9-5-7-10(8-6-9)19-14-13(18)15(20)11-3-1-2-4-12(11)16(14)21/h1-8,19H |
| InChIKey | LBKUWRCJEFJUNW-UHFFFAOYSA-N |
| Molecular Weight | 318.159 g/mol |
| SMILES | C1(=O)C(=C(C(=O)C2=C1C=CC=C2)NC1=CC=C(C=C1)Cl)Cl |