| SpectraBase Compound ID | A09UcC2DoGJ |
|---|---|
| InChI | InChI=1S/C16H17NO/c1-16(2,3)15(18)14-11-7-10-13(17-14)12-8-5-4-6-9-12/h4-11H,1-3H3 |
| InChIKey | DLKOQWOITCUXDX-UHFFFAOYSA-N |
| Mol Weight | 239.32 g/mol |
| Molecular Formula | C16H17NO |
| Exact Mass | 239.131014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 42aFAA74A01 |
|---|---|
| Name | 2,2-Dimethyl-( 6-phenylpyridin-2-yl) propanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.131014170 u |
| Formula | C16H17NO |
| InChI | InChI=1S/C16H17NO/c1-16(2,3)15(18)14-11-7-10-13(17-14)12-8-5-4-6-9-12/h4-11H,1-3H3 |
| InChIKey | DLKOQWOITCUXDX-UHFFFAOYSA-N |
| Molecular Weight | 239.318 g/mol |
| SMILES | C1(=NC(=CC=C1)C1=CC=CC=C1)C(C(C)(C)C)=O |