| SpectraBase Compound ID | 3k671QuX6K |
|---|---|
| InChI | InChI=1S/C14H8Cl2N2O2/c15-10-5-7(6-11(16)12(10)17)18-13(19)8-3-1-2-4-9(8)14(18)20/h1-6H,17H2 |
| InChIKey | AWRGNHYMQZGQBN-UHFFFAOYSA-N |
| Mol Weight | 307.14 g/mol |
| Molecular Formula | C14H8Cl2N2O2 |
| Exact Mass | 305.996283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6nyK4xwWTMe |
|---|---|
| Name | 1H-Isoindole-1,3(2H)-dione, 2-(4-amino-3,5-dichlorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.996282904 u |
| Formula | C14H8Cl2N2O2 |
| InChI | InChI=1S/C14H8Cl2N2O2/c15-10-5-7(6-11(16)12(10)17)18-13(19)8-3-1-2-4-9(8)14(18)20/h1-6H,17H2 |
| InChIKey | AWRGNHYMQZGQBN-UHFFFAOYSA-N |
| Molecular Weight | 307.136 g/mol |
| SMILES | NC1=C(C=C(N2C(C=3C=CC=CC3C2=O)=O)C=C1Cl)Cl |