| SpectraBase Compound ID | GNlhSbHcfyM |
|---|---|
| InChI | InChI=1S/C14H16BrNO2/c15-12-4-1-11(2-5-12)3-6-14(18)16-9-7-13(17)8-10-16/h1-6,13,17H,7-10H2/b6-3+ |
| InChIKey | QYNONMWWGFKWAC-ZZXKWVIFSA-N |
| Mol Weight | 310.19 g/mol |
| Molecular Formula | C14H16BrNO2 |
| Exact Mass | 309.036442 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 | 1G2JWDbjRsQ |
|---|---|
| Name | 3-(4-Bromophenyl)-1-(4-hydroxypiperidin-1-yl)-propenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.036441757 u |
| Formula | C14H16BrNO2 |
| InChI | InChI=1S/C14H16BrNO2/c15-12-4-1-11(2-5-12)3-6-14(18)16-9-7-13(17)8-10-16/h1-6,13,17H,7-10H2/b6-3+ |
| InChIKey | QYNONMWWGFKWAC-ZZXKWVIFSA-N |
| Molecular Weight | 310.191 g/mol |
| SMILES | C1=C(C=CC(=C1)\C=C\C(N1CCC(CC1)O)=O)Br |