![1-methyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-4-carboxamide](/api/spectrum/3NiYOra572c/structure.png?h=300&w=458 "1-methyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-4-carboxamide")
| SpectraBase Compound ID | 7hKE7tNBBch |
|---|---|
| InChI | InChI=1S/C14H17N3O/c1-10-4-6-12(7-5-10)11(2)16-14(18)13-8-15-17(3)9-13/h4-9,11H,1-3H3,(H,16,18) |
| InChIKey | AKHCNSVWGJKROJ-UHFFFAOYSA-N |
| Mol Weight | 243.31 g/mol |
| Molecular Formula | C14H17N3O |
| Exact Mass | 243.137162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3NiYOra572c |
|---|---|
| Name | 1-Methyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-4-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.137162178 u |
| Formula | C14H17N3O |
| InChI | InChI=1S/C14H17N3O/c1-10-4-6-12(7-5-10)11(2)16-14(18)13-8-15-17(3)9-13/h4-9,11H,1-3H3,(H,16,18) |
| InChIKey | AKHCNSVWGJKROJ-UHFFFAOYSA-N |
| Molecular Weight | 243.310 g/mol |
| SMILES | N(C(C=1C=CC(=CC1)C)C)C(C1=CN(C)N=C1)=O |