| SpectraBase Compound ID | FtE59gGS7nR |
|---|---|
| InChI | InChI=1S/C11H8ClNO2/c1-13-9-8(12)10(14)6-4-2-3-5-7(6)11(9)15/h2-5,13H,1H3 |
| InChIKey | VOILDFZXZBSUTR-UHFFFAOYSA-N |
| Mol Weight | 221.64 g/mol |
| Molecular Formula | C11H8ClNO2 |
| Exact Mass | 221.024356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5R9V5jRB7Zy |
|---|---|
| Name | 2-Chloro-3-(methylamino)-1,4-naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.024356200 u |
| Formula | C11H8ClNO2 |
| InChI | InChI=1S/C11H8ClNO2/c1-13-9-8(12)10(14)6-4-2-3-5-7(6)11(9)15/h2-5,13H,1H3 |
| InChIKey | VOILDFZXZBSUTR-UHFFFAOYSA-N |
| Molecular Weight | 221.643 g/mol |
| SMILES | N(C=1C(C2=C(C(C1Cl)=O)C=CC=C2)=O)C |