| SpectraBase Compound ID | 3wmLct9Yihu |
|---|---|
| InChI | InChI=1S/C8H10N2O2/c1-2-10-6-7(5-9-10)3-4-8(11)12/h3-6H,2H2,1H3,(H,11,12)/b4-3+ |
| InChIKey | PEOBEMGZOZNVGK-ONEGZZNKSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C8H10N2O2 |
| Exact Mass | 166.074228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fe2BHjfZr5C |
|---|---|
| Name | Propenoic acid, 3-(1-ethyl-4-pyrazolyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.074227568 u |
| Formula | C8H10N2O2 |
| InChI | InChI=1S/C8H10N2O2/c1-2-10-6-7(5-9-10)3-4-8(11)12/h3-6H,2H2,1H3,(H,11,12)/b4-3+ |
| InChIKey | PEOBEMGZOZNVGK-ONEGZZNKSA-N |
| Molecular Weight | 166.180 g/mol |
| SMILES | CCN1C=C(C=N1)\C=C\C(=O)O |