| SpectraBase Compound ID | JW5kzcO2MaG |
|---|---|
| InChI | InChI=1S/C12H12FN3O/c1-16-8-10(7-15-16)12(17)14-6-9-4-2-3-5-11(9)13/h2-5,7-8H,6H2,1H3,(H,14,17) |
| InChIKey | RHGVMKXGKTXKNM-UHFFFAOYSA-N |
| Mol Weight | 233.25 g/mol |
| Molecular Formula | C12H12FN3O |
| Exact Mass | 233.09644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IthWP9HMD8z |
|---|---|
| Name | N-(2-Fluorobenzyl)-1-methyl-1H-pyrazole-4-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.096440180 u |
| Formula | C12H12FN3O |
| InChI | InChI=1S/C12H12FN3O/c1-16-8-10(7-15-16)12(17)14-6-9-4-2-3-5-11(9)13/h2-5,7-8H,6H2,1H3,(H,14,17) |
| InChIKey | RHGVMKXGKTXKNM-UHFFFAOYSA-N |
| Molecular Weight | 233.246 g/mol |
| SMILES | N(CC1=C(F)C=CC=C1)C(C1=CN(C)N=C1)=O |