| SpectraBase Compound ID | IuVVWkcoFEt |
|---|---|
| InChI | InChI=1S/C14H17NO2/c16-13(12-7-3-1-4-8-12)11-14(17)15-9-5-2-6-10-15/h1,3-4,7-8H,2,5-6,9-11H2 |
| InChIKey | WYONJHQETBNPEB-UHFFFAOYSA-N |
| Mol Weight | 231.29 g/mol |
| Molecular Formula | C14H17NO2 |
| Exact Mass | 231.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 95iYpqOc2FC |
|---|---|
| Name | 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.125928789 u |
| Formula | C14H17NO2 |
| InChI | InChI=1S/C14H17NO2/c16-13(12-7-3-1-4-8-12)11-14(17)15-9-5-2-6-10-15/h1,3-4,7-8H,2,5-6,9-11H2 |
| InChIKey | WYONJHQETBNPEB-UHFFFAOYSA-N |
| Molecular Weight | 231.295 g/mol |
| SMILES | C1(=CC=CC=C1)C(=O)CC(=O)N1CCCCC1 |