| SpectraBase Compound ID | JAynKwpUS61 |
|---|---|
| InChI | InChI=1S/C16H23NO3/c1-19-15-7-6-13(12-16(15)20-2)14(18)8-11-17-9-4-3-5-10-17/h6-7,12H,3-5,8-11H2,1-2H3 |
| InChIKey | NVWLYLRFHQLHSN-UHFFFAOYSA-N |
| Mol Weight | 277.36 g/mol |
| Molecular Formula | C16H23NO3 |
| Exact Mass | 277.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Iwvtgwsrxpw |
|---|---|
| Name | 1-(3,4-Dimethoxy-phenyl)-3-piperidin-1-yl-propan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.167793602 u |
| Formula | C16H23NO3 |
| InChI | InChI=1S/C16H23NO3/c1-19-15-7-6-13(12-16(15)20-2)14(18)8-11-17-9-4-3-5-10-17/h6-7,12H,3-5,8-11H2,1-2H3 |
| InChIKey | NVWLYLRFHQLHSN-UHFFFAOYSA-N |
| SMILES | C1(=CC(OC)=C(C=C1)OC)C(CCN1CCCCC1)=O |