| SpectraBase Compound ID | 1txnuuDafOj |
|---|---|
| InChI | InChI=1S/C8H12N2/c1-4-5-10-8(3)6-7(2)9-10/h4,6H,1,5H2,2-3H3 |
| InChIKey | NXAGTQRRYZTDKV-UHFFFAOYSA-N |
| Mol Weight | 136.2 g/mol |
| Molecular Formula | C8H12N2 |
| Exact Mass | 136.100048 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CSfBNMoVg2f |
|---|---|
| Name | 1-Allyl-3,5-dimethylpyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.100048394 u |
| Formula | C8H12N2 |
| InChI | InChI=1S/C8H12N2/c1-4-5-10-8(3)6-7(2)9-10/h4,6H,1,5H2,2-3H3 |
| InChIKey | NXAGTQRRYZTDKV-UHFFFAOYSA-N |
| Molecular Weight | 136.198 g/mol |
| SMILES | C=1(N(N=C(C1)C)CC=C)C |