![Trans-1-[3,4-(methylenedioxy)phenyl]-5-phenyl-1,4-pentadien-3-one](/api/spectrum/JVjvc39cNN8/structure.png?h=300&w=458 "Trans-1-[3,4-(methylenedioxy)phenyl]-5-phenyl-1,4-pentadien-3-one")
| SpectraBase Compound ID | 40eipiHngAU |
|---|---|
| InChI | InChI=1S/C18H14O3/c19-16(9-6-14-4-2-1-3-5-14)10-7-15-8-11-17-18(12-15)21-13-20-17/h1-12H,13H2/b9-6+,10-7+ |
| InChIKey | LZQONVNSDHINSR-KZZDLZNXSA-N |
| Mol Weight | 278.31 g/mol |
| Molecular Formula | C18H14O3 |
| Exact Mass | 278.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JVjvc39cNN8 |
|---|---|
| Name | Trans-1-[3,4-(methylenedioxy)phenyl]-5-phenyl-1,4-pentadien-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.094294308 u |
| Formula | C18H14O3 |
| InChI | InChI=1S/C18H14O3/c19-16(9-6-14-4-2-1-3-5-14)10-7-15-8-11-17-18(12-15)21-13-20-17/h1-12H,13H2/b9-6+,10-7+ |
| InChIKey | LZQONVNSDHINSR-KZZDLZNXSA-N |
| Molecular Weight | 278.307 g/mol |
| SMILES | C=1C(=CC=CC1)\C=C\C(\C=C\C=1C=CC=2OCOC2C1)=O |