| SpectraBase Compound ID | 5wXIOijp9e |
|---|---|
| InChI | InChI=1S/C15H16N2O2/c1-11-13(10-17(2)16-11)6-9-15(18)12-4-7-14(19-3)8-5-12/h4-10H,1-3H3/b9-6+ |
| InChIKey | RALJVYDMGWFTLX-RMKNXTFCSA-N |
| Mol Weight | 256.3 g/mol |
| Molecular Formula | C15H16N2O2 |
| Exact Mass | 256.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | InEIFakGKOr |
|---|---|
| Name | (E)-3-(1,3-Dimethyl-4-pyrazolyl)-1-(4-methoxyphenyl)-2-propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.121177761 u |
| Formula | C15H16N2O2 |
| InChI | InChI=1S/C15H16N2O2/c1-11-13(10-17(2)16-11)6-9-15(18)12-4-7-14(19-3)8-5-12/h4-10H,1-3H3/b9-6+ |
| InChIKey | RALJVYDMGWFTLX-RMKNXTFCSA-N |
| Molecular Weight | 256.305 g/mol |
| SMILES | C1(=CC=C(C=C1)OC)C(=O)\C=C\C=1C(=NN(C1)C)C |