| SpectraBase Compound ID | DoqMG6zMAJN |
|---|---|
| InChI | InChI=1S/C14H15Cl2N3O/c1-4-19-9(3)13(8(2)18-19)17-14(20)12-10(15)6-5-7-11(12)16/h5-7H,4H2,1-3H3,(H,17,20) |
| InChIKey | XIZJXRIKWRUQPW-UHFFFAOYSA-N |
| Mol Weight | 312.2 g/mol |
| Molecular Formula | C14H15Cl2N3O |
| Exact Mass | 311.059218 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HKR2YS0DYL8 |
|---|---|
| Name | 2,6-Dichloro-N-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.059217514 u |
| Formula | C14H15Cl2N3O |
| InChI | InChI=1S/C14H15Cl2N3O/c1-4-19-9(3)13(8(2)18-19)17-14(20)12-10(15)6-5-7-11(12)16/h5-7H,4H2,1-3H3,(H,17,20) |
| InChIKey | XIZJXRIKWRUQPW-UHFFFAOYSA-N |
| Molecular Weight | 312.200 g/mol |
| SMILES | N(C1=C(N(CC)N=C1C)C)C(C=1C(Cl)=CC=CC1Cl)=O |