![3-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl]pentane-2,4-dione](/api/spectrum/HO7msQ2g9zO/structure.png?h=300&w=458 "3-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl]pentane-2,4-dione")
| SpectraBase Compound ID | DomurIrYXWw |
|---|---|
| InChI | InChI=1S/C15H18O4/c1-10(16)13(11(2)17)6-4-5-12-7-8-14(18)15(9-12)19-3/h4-5,7-9,13,18H,6H2,1-3H3/b5-4+ |
| InChIKey | YSGAEDGEXZISSH-SNAWJCMRSA-N |
| Mol Weight | 262.3 g/mol |
| Molecular Formula | C15H18O4 |
| Exact Mass | 262.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HO7msQ2g9zO |
|---|---|
| Name | 3-[(E)-3-(3-Methoxy-4-oxidanyl-phenyl)prop-2-enyl]pentane-2,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.120509056 u |
| Formula | C15H18O4 |
| InChI | InChI=1S/C15H18O4/c1-10(16)13(11(2)17)6-4-5-12-7-8-14(18)15(9-12)19-3/h4-5,7-9,13,18H,6H2,1-3H3/b5-4+ |
| InChIKey | YSGAEDGEXZISSH-SNAWJCMRSA-N |
| Molecular Weight | 262.305 g/mol |
| SMILES | C(C(=O)C)(C(=O)C)C\C=C\C=1C=C(OC)C(=CC1)O |