| SpectraBase Compound ID | BVTtRIZ89mY |
|---|---|
| InChI | InChI=1S/C4H6N4O/c1-3(9)8-2-6-4(5)7-8/h2H,1H3,(H2,5,7) |
| InChIKey | KEVLZFVVRTWLGF-UHFFFAOYSA-N |
| Mol Weight | 126.12 g/mol |
| Molecular Formula | C4H6N4O |
| Exact Mass | 126.054161 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IUVVMavV7OP |
|---|---|
| Name | 1-Acetyl-3-amino-1,2,4-triazole; 1H-1,2,4-triazol-3-amine, 1-acetyl-; 1H-1,2,4-triazole, 1-acetyl-3-amino- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.054160828 u |
| Formula | C4H6N4O |
| InChI | InChI=1S/C4H6N4O/c1-3(9)8-2-6-4(5)7-8/h2H,1H3,(H2,5,7) |
| InChIKey | KEVLZFVVRTWLGF-UHFFFAOYSA-N |
| Molecular Weight | 126.119 g/mol |
| SMILES | NC=1N=CN(N1)C(C)=O |