![4-Hydroxy-3-[5-(4-methoxyphenyl)penta-2,4-dienoyl]-6-methylpyran-2-one](/api/spectrum/67JMEd1Ppgw/structure.png?h=300&w=458 "4-Hydroxy-3-[5-(4-methoxyphenyl)penta-2,4-dienoyl]-6-methylpyran-2-one")
| SpectraBase Compound ID | ob7uwGlojr |
|---|---|
| InChI | InChI=1S/C18H16O5/c1-12-11-16(20)17(18(21)23-12)15(19)6-4-3-5-13-7-9-14(22-2)10-8-13/h3-11,20H,1-2H3/b5-3+,6-4+ |
| InChIKey | HQKLBPYALIMCPG-GGWOSOGESA-N |
| Mol Weight | 312.32 g/mol |
| Molecular Formula | C18H16O5 |
| Exact Mass | 312.099774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 67JMEd1Ppgw |
|---|---|
| Name | 4-Hydroxy-3-[5-(4-methoxyphenyl)penta-2,4-dienoyl]-6-methylpyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.099773610 u |
| Formula | C18H16O5 |
| InChI | InChI=1S/C18H16O5/c1-12-11-16(20)17(18(21)23-12)15(19)6-4-3-5-13-7-9-14(22-2)10-8-13/h3-11,20H,1-2H3/b5-3+,6-4+ |
| InChIKey | HQKLBPYALIMCPG-GGWOSOGESA-N |
| SMILES | CC1=CC(=C(C(\C=C\C=C\C2=CC=C(OC)C=C2)=O)C(O1)=O)O |