| SpectraBase Compound ID | IxDwZyCahyx |
|---|---|
| InChI | InChI=1S/C12H20ClN3O/c1-5-15(6-2)11(17)7-8-16-10(4)12(13)9(3)14-16/h5-8H2,1-4H3 |
| InChIKey | VUSBPVWNEQZKCD-UHFFFAOYSA-N |
| Mol Weight | 257.76 g/mol |
| Molecular Formula | C12H20ClN3O |
| Exact Mass | 257.12949 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5QGppjBEpY8 |
|---|---|
| Name | 3-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N,N-diethylpropanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.129489975 u |
| Formula | C12H20ClN3O |
| InChI | InChI=1S/C12H20ClN3O/c1-5-15(6-2)11(17)7-8-16-10(4)12(13)9(3)14-16/h5-8H2,1-4H3 |
| InChIKey | VUSBPVWNEQZKCD-UHFFFAOYSA-N |
| SMILES | CC1=NN(C(=C1Cl)C)CCC(=O)N(CC)CC |