| SpectraBase Compound ID | DlgwvtI4Vs5 |
|---|---|
| InChI | InChI=1S/C9H5Cl4NO/c10-5-1-3-6(4-2-5)14-9(15)7(11)8(12)13/h1-4H,(H,14,15) |
| InChIKey | VNYJPLUXYCTVIW-UHFFFAOYSA-N |
| Mol Weight | 285.0 g/mol |
| Molecular Formula | C9H5Cl4NO |
| Exact Mass | 282.912525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1QArSMbxL8q |
|---|---|
| Name | Propenamide, 2,3,3-trichloro-N-(4-chlorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.912524584 u |
| Formula | C9H5Cl4NO |
| InChI | InChI=1S/C9H5Cl4NO/c10-5-1-3-6(4-2-5)14-9(15)7(11)8(12)13/h1-4H,(H,14,15) |
| InChIKey | VNYJPLUXYCTVIW-UHFFFAOYSA-N |
| Molecular Weight | 284.957 g/mol |
| SMILES | C(C(NC=1C=CC(=CC1)Cl)=O)(=C(Cl)Cl)Cl |