| SpectraBase Compound ID | LlvMFw7S930 |
|---|---|
| InChI | InChI=1S/C11H13Cl2NO/c1-7(2)6-14-11(15)8-3-4-9(12)10(13)5-8/h3-5,7H,6H2,1-2H3,(H,14,15) |
| InChIKey | FJKZDEJNYCPWKR-UHFFFAOYSA-N |
| Mol Weight | 246.14 g/mol |
| Molecular Formula | C11H13Cl2NO |
| Exact Mass | 245.037419 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ei1Env0zYBr |
|---|---|
| Name | 3,4-Dichloro-N-isobutylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.037419442 u |
| Formula | C11H13Cl2NO |
| InChI | InChI=1S/C11H13Cl2NO/c1-7(2)6-14-11(15)8-3-4-9(12)10(13)5-8/h3-5,7H,6H2,1-2H3,(H,14,15) |
| InChIKey | FJKZDEJNYCPWKR-UHFFFAOYSA-N |
| Molecular Weight | 246.137 g/mol |
| SMILES | C1(Cl)=C(C=CC(=C1)C(=O)NCC(C)C)Cl |