| SpectraBase Compound ID | JYypYPyjfPt |
|---|---|
| InChI | InChI=1S/C19H16O3/c20-18(17-11-5-2-6-12-17)13-14-19(21)22-15-7-10-16-8-3-1-4-9-16/h1-14H,15H2/b10-7-,14-13+ |
| InChIKey | IXDPTJUUPIPUHR-OEIMXGEJSA-N |
| Mol Weight | 292.33 g/mol |
| Molecular Formula | C19H16O3 |
| Exact Mass | 292.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SqAqi4fj8C |
|---|---|
| Name | 4-oxo-4-Phenyl-but-2-enoic acid 3-phenyl-allyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.109944372 u |
| Formula | C19H16O3 |
| InChI | InChI=1S/C19H16O3/c20-18(17-11-5-2-6-12-17)13-14-19(21)22-15-7-10-16-8-3-1-4-9-16/h1-14H,15H2/b10-7-,14-13+ |
| InChIKey | IXDPTJUUPIPUHR-OEIMXGEJSA-N |
| SMILES | C(\C=C\C(C=1C=CC=CC1)=O)(OC\C=C/C1=CC=CC=C1)=O |