| SpectraBase Compound ID | GMhuXuO5G4y |
|---|---|
| InChI | InChI=1S/C9H9N3O/c1-7-3-5-11-8(6-7)12-9(13)2-4-10/h3,5-6H,2H2,1H3,(H,11,12,13) |
| InChIKey | VBWZRNAQFLUSLN-UHFFFAOYSA-N |
| Mol Weight | 175.19 g/mol |
| Molecular Formula | C9H9N3O |
| Exact Mass | 175.074562 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Vx0wICYujA |
|---|---|
| Name | 2-Cyano-N-(4-methyl-2-pyridinyl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.074561921 u |
| Formula | C9H9N3O |
| InChI | InChI=1S/C9H9N3O/c1-7-3-5-11-8(6-7)12-9(13)2-4-10/h3,5-6H,2H2,1H3,(H,11,12,13) |
| InChIKey | VBWZRNAQFLUSLN-UHFFFAOYSA-N |
| SMILES | N(C1=NC=CC(=C1)C)C(CC#N)=O |