![piperidine, 1-[(2E)-3-(1,3-benzodioxol-5-yl)-1-oxo-2-propenyl]-4-methyl-](/api/spectrum/2u6noEEnfUo/structure.png?h=300&w=458 "piperidine, 1-[(2E)-3-(1,3-benzodioxol-5-yl)-1-oxo-2-propenyl]-4-methyl-")
| SpectraBase Compound ID | GlhErjo1ybW |
|---|---|
| InChI | InChI=1S/C16H19NO3/c1-12-6-8-17(9-7-12)16(18)5-3-13-2-4-14-15(10-13)20-11-19-14/h2-5,10,12H,6-9,11H2,1H3/b5-3+ |
| InChIKey | BIXTXZXWPUQSJC-HWKANZROSA-N |
| Mol Weight | 273.33 g/mol |
| Molecular Formula | C16H19NO3 |
| Exact Mass | 273.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2u6noEEnfUo |
|---|---|
| Name | Piperidine, 1-[(2E)-3-(1,3-benzodioxol-5-yl)-1-oxo-2-propenyl]-4-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.136493473 u |
| Formula | C16H19NO3 |
| InChI | InChI=1S/C16H19NO3/c1-12-6-8-17(9-7-12)16(18)5-3-13-2-4-14-15(10-13)20-11-19-14/h2-5,10,12H,6-9,11H2,1H3/b5-3+ |
| InChIKey | BIXTXZXWPUQSJC-HWKANZROSA-N |
| SMILES | CC1CCN(C(\C=C\C2=CC=3OCOC3C=C2)=O)CC1 |