| SpectraBase Compound ID | EZu1ZqP8ghl |
|---|---|
| InChI | InChI=1S/C15H20O3/c1-3-4-7-12-18-15(16)11-10-13-8-5-6-9-14(13)17-2/h5-6,8-11H,3-4,7,12H2,1-2H3/b11-10+ |
| InChIKey | ZSSLQRPKGBDQRR-ZHACJKMWSA-N |
| Mol Weight | 248.32 g/mol |
| Molecular Formula | C15H20O3 |
| Exact Mass | 248.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dn2OzP7LBoA |
|---|---|
| Name | Trans-2-methoxycinnamic acid, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.141244501 u |
| Formula | C15H20O3 |
| InChI | InChI=1S/C15H20O3/c1-3-4-7-12-18-15(16)11-10-13-8-5-6-9-14(13)17-2/h5-6,8-11H,3-4,7,12H2,1-2H3/b11-10+ |
| InChIKey | ZSSLQRPKGBDQRR-ZHACJKMWSA-N |
| Molecular Weight | 248.322 g/mol |
| SMILES | C(OCCCCC)(=O)\C=C\C1=C(OC)C=CC=C1 |