| SpectraBase Compound ID | KDg0IchGl0v |
|---|---|
| InChI | InChI=1S/C14H16O4/c1-3-17-13(15)10-9-11(2)18-14(16)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3/b10-9+/t11-/m0/s1 |
| InChIKey | FWCRWMXFEBUHAX-USKTWTLRSA-N |
| Mol Weight | 248.28 g/mol |
| Molecular Formula | C14H16O4 |
| Exact Mass | 248.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FWrDNxN3FyN |
|---|---|
| Name | Ethyl (E,S)-4-benzoyloxypent-2-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.104858991 u |
| Formula | C14H16O4 |
| InChI | InChI=1S/C14H16O4/c1-3-17-13(15)10-9-11(2)18-14(16)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3/b10-9+/t11-/m0/s1 |
| InChIKey | FWCRWMXFEBUHAX-USKTWTLRSA-N |
| Molecular Weight | 248.278 g/mol |
| SMILES | C(O[C@](\C=C\C(=O)OCC)(C)[H])(=O)C1=CC=CC=C1 |