| SpectraBase Compound ID | AHw4VbxoxjC |
|---|---|
| InChI | InChI=1S/C8H12N2O/c1-3-4-10-7(2)8(6-11)5-9-10/h5-6H,3-4H2,1-2H3 |
| InChIKey | AUAXPAUSORRXAT-UHFFFAOYSA-N |
| Mol Weight | 152.2 g/mol |
| Molecular Formula | C8H12N2O |
| Exact Mass | 152.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8R99YRcpsH8 |
|---|---|
| Name | 5-Methyl-1-propyl-1H-pyrazole-4-carbaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.094963013 u |
| Formula | C8H12N2O |
| InChI | InChI=1S/C8H12N2O/c1-3-4-10-7(2)8(6-11)5-9-10/h5-6H,3-4H2,1-2H3 |
| InChIKey | AUAXPAUSORRXAT-UHFFFAOYSA-N |
| Molecular Weight | 152.197 g/mol |
| SMILES | C1=NN(C(=C1C=O)C)CCC |