| SpectraBase Compound ID | HhXSnlt7fC4 |
|---|---|
| InChI | InChI=1S/C12H14ClNO2/c1-3-11(15)14(12(16)4-2)10-7-5-9(13)6-8-10/h5-8H,3-4H2,1-2H3 |
| InChIKey | BTGXOOOBNIWSID-UHFFFAOYSA-N |
| Mol Weight | 239.7 g/mol |
| Molecular Formula | C12H14ClNO2 |
| Exact Mass | 239.071306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EePctNWxCl2 |
|---|---|
| Name | N-(4-Chlorophenyl)-N-propanoylpropanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.071306393 u |
| Formula | C12H14ClNO2 |
| InChI | InChI=1S/C12H14ClNO2/c1-3-11(15)14(12(16)4-2)10-7-5-9(13)6-8-10/h5-8H,3-4H2,1-2H3 |
| InChIKey | BTGXOOOBNIWSID-UHFFFAOYSA-N |
| Molecular Weight | 239.702 g/mol |
| SMILES | C=1(N(C(CC)=O)C(CC)=O)C=CC(=CC1)Cl |