![3-[(4-Methyl-2-pyridyl)amino]crotonophenone](/api/spectrum/AN01g9WBZdF/structure.png?h=300&w=458 "3-[(4-Methyl-2-pyridyl)amino]crotonophenone")
| SpectraBase Compound ID | Hk2sLomIwBC |
|---|---|
| InChI | InChI=1S/C16H16N2O/c1-12-8-9-17-16(10-12)18-13(2)11-15(19)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,17,18) |
| InChIKey | ZBROJKWMDHYUOF-UHFFFAOYSA-N |
| Mol Weight | 252.32 g/mol |
| Molecular Formula | C16H16N2O |
| Exact Mass | 252.126263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AN01g9WBZdF |
|---|---|
| Name | 3-[(4-Methyl-2-pyridyl)amino]crotonophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.126263142 u |
| Formula | C16H16N2O |
| InChI | InChI=1S/C16H16N2O/c1-12-8-9-17-16(10-12)18-13(2)11-15(19)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,17,18) |
| InChIKey | ZBROJKWMDHYUOF-UHFFFAOYSA-N |
| Molecular Weight | 252.317 g/mol |
| SMILES | N(C(=CC(C1=CC=CC=C1)=O)C)C=1N=CC=C(C1)C |