| SpectraBase Compound ID | 5E5JqXcvkKy |
|---|---|
| InChI | InChI=1S/C6H8N2O/c1-2-8-4-6(5-9)3-7-8/h3-5H,2H2,1H3 |
| InChIKey | UMSDESWKSPAALM-UHFFFAOYSA-N |
| Mol Weight | 124.14 g/mol |
| Molecular Formula | C6H8N2O |
| Exact Mass | 124.063663 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5nADbySZb60 |
|---|---|
| Name | 1H-Pyrazole-4-carboxaldehyde, 1-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 124.063662885 u |
| Formula | C6H8N2O |
| InChI | InChI=1S/C6H8N2O/c1-2-8-4-6(5-9)3-7-8/h3-5H,2H2,1H3 |
| InChIKey | UMSDESWKSPAALM-UHFFFAOYSA-N |
| Molecular Weight | 124.143 g/mol |
| SMILES | CCN1C=C(C=N1)C=O |