![3-[3,4-(Methylenedioxy)phenyl]-1-(4-pyridyl)-2-propen-1-one](/api/spectrum/AHTwWg18tzC/structure.png?h=300&w=458 "3-[3,4-(Methylenedioxy)phenyl]-1-(4-pyridyl)-2-propen-1-one")
| SpectraBase Compound ID | KFqGL5KVC0I |
|---|---|
| InChI | InChI=1S/C15H11NO3/c17-13(12-2-1-7-16-9-12)5-3-11-4-6-14-15(8-11)19-10-18-14/h1-9H,10H2 |
| InChIKey | SWCPAKKAUGIZQP-UHFFFAOYSA-N |
| Mol Weight | 253.26 g/mol |
| Molecular Formula | C15H11NO3 |
| Exact Mass | 253.073893 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 | AHTwWg18tzC |
|---|---|
| Name | 3-[3,4-(Methylenedioxy)phenyl]-1-(4-pyridyl)-2-propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.073893215 u |
| Formula | C15H11NO3 |
| InChI | InChI=1S/C15H11NO3/c17-13(12-2-1-7-16-9-12)5-3-11-4-6-14-15(8-11)19-10-18-14/h1-9H,10H2 |
| InChIKey | SWCPAKKAUGIZQP-UHFFFAOYSA-N |
| Molecular Weight | 253.257 g/mol |
| SMILES | C=1N=CC=CC1C(=O)C=CC=1C=CC2=C(C1)OCO2 |