| SpectraBase Compound ID | 9pMXQp2v5v9 |
|---|---|
| InChI | InChI=1S/C16H10ClNO3/c17-13-14(18-9-5-7-10(19)8-6-9)16(21)12-4-2-1-3-11(12)15(13)20/h1-8,18-19H |
| InChIKey | BAPUUJSXNSGXLT-UHFFFAOYSA-N |
| Mol Weight | 299.71 g/mol |
| Molecular Formula | C16H10ClNO3 |
| Exact Mass | 299.034921 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KYyjhOWsf7i |
|---|---|
| Name | 2-Chloro-3-(4-hydroxyphenylamino)-1,4-naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.034920883 u |
| Formula | C16H10ClNO3 |
| InChI | InChI=1S/C16H10ClNO3/c17-13-14(18-9-5-7-10(19)8-6-9)16(21)12-4-2-1-3-11(12)15(13)20/h1-8,18-19H |
| InChIKey | BAPUUJSXNSGXLT-UHFFFAOYSA-N |
| SMILES | C12=C(C=CC=C2)C(C(=C(C1=O)NC1=CC=C(C=C1)O)Cl)=O |