| SpectraBase Compound ID | Jgo8BelolvG |
|---|---|
| InChI | InChI=1S/C11H10N4O/c1-16-10-4-2-9(3-5-10)15-11(13)8(6-12)7-14-15/h2-5,7H,13H2,1H3 |
| InChIKey | AIQYZOPCGVEHML-UHFFFAOYSA-N |
| Mol Weight | 214.23 g/mol |
| Molecular Formula | C11H10N4O |
| Exact Mass | 214.085461 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8EkHTmGFXp4 |
|---|---|
| Name | 5-Amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.085460957 u |
| Formula | C11H10N4O |
| InChI | InChI=1S/C11H10N4O/c1-16-10-4-2-9(3-5-10)15-11(13)8(6-12)7-14-15/h2-5,7H,13H2,1H3 |
| InChIKey | AIQYZOPCGVEHML-UHFFFAOYSA-N |
| Molecular Weight | 214.228 g/mol |
| SMILES | C1=NN(C(=C1C#N)N)C1=CC=C(C=C1)OC |