![1-(Benzo[D][1,3]dioxol-5-yl)-2-(2-methylpiperidin-1-yl)propan-1-one](/api/spectrum/L0GBgIhS7pg/structure.png?h=300&w=458 "1-(Benzo[D][1,3]dioxol-5-yl)-2-(2-methylpiperidin-1-yl)propan-1-one")
| SpectraBase Compound ID | 5NvQxQFdOyB |
|---|---|
| InChI | InChI=1S/C16H21NO3/c1-11-5-3-4-8-17(11)12(2)16(18)13-6-7-14-15(9-13)20-10-19-14/h6-7,9,11-12H,3-5,8,10H2,1-2H3 |
| InChIKey | PSBUWWUIPNCQFB-UHFFFAOYSA-N |
| Mol Weight | 275.35 g/mol |
| Molecular Formula | C16H21NO3 |
| Exact Mass | 275.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L0GBgIhS7pg |
|---|---|
| Name | 1-(Benzo[D][1,3]dioxol-5-yl)-2-(2-methylpiperidin-1-yl)propan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.152143537 u |
| Formula | C16H21NO3 |
| InChI | InChI=1S/C16H21NO3/c1-11-5-3-4-8-17(11)12(2)16(18)13-6-7-14-15(9-13)20-10-19-14/h6-7,9,11-12H,3-5,8,10H2,1-2H3 |
| InChIKey | PSBUWWUIPNCQFB-UHFFFAOYSA-N |
| Molecular Weight | 275.348 g/mol |
| SMILES | C12=C(C=CC(=C2)C(C(N2CCCCC2C)C)=O)OCO1 |