| SpectraBase Compound ID | 8Q4dfmvTT0t |
|---|---|
| InChI | InChI=1S/C18H18O2/c19-18(20-15-17-12-5-2-6-13-17)14-8-7-11-16-9-3-1-4-10-16/h1-6,8-10,12-14H,7,11,15H2/b14-8+ |
| InChIKey | QHMKYYZASZLBKA-RIYZIHGNSA-N |
| Mol Weight | 266.34 g/mol |
| Molecular Formula | C18H18O2 |
| Exact Mass | 266.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LsamwnIDrPg |
|---|---|
| Name | 5-Phenyl-2(E)-pentenoic acid benzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.130679818 u |
| Formula | C18H18O2 |
| InChI | InChI=1S/C18H18O2/c19-18(20-15-17-12-5-2-6-13-17)14-8-7-11-16-9-3-1-4-10-16/h1-6,8-10,12-14H,7,11,15H2/b14-8+ |
| InChIKey | QHMKYYZASZLBKA-RIYZIHGNSA-N |
| Molecular Weight | 266.340 g/mol |
| SMILES | C(\C=C\CCC=1C=CC=CC1)(=O)OCC=1C=CC=CC1 |