| SpectraBase Compound ID | F802OYBX9Qc |
|---|---|
| InChI | InChI=1S/C19H20O2/c1-21-19(20)18(15-17-11-6-3-7-12-17)14-8-13-16-9-4-2-5-10-16/h2-12,14,18H,13,15H2,1H3/b14-8+ |
| InChIKey | ZUBTWWOQDGALGP-RIYZIHGNSA-N |
| Mol Weight | 280.37 g/mol |
| Molecular Formula | C19H20O2 |
| Exact Mass | 280.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DIlGu2RlG2I |
|---|---|
| Name | Methyl (E)-2-benzyl-5-phenyl-3-pentenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.146329882 u |
| Formula | C19H20O2 |
| InChI | InChI=1S/C19H20O2/c1-21-19(20)18(15-17-11-6-3-7-12-17)14-8-13-16-9-4-2-5-10-16/h2-12,14,18H,13,15H2,1H3/b14-8+ |
| InChIKey | ZUBTWWOQDGALGP-RIYZIHGNSA-N |
| SMILES | C(C(\C=C\CC1=CC=CC=C1)CC1=CC=CC=C1)(=O)OC |