| SpectraBase Compound ID | L0LQLvySxcn |
|---|---|
| InChI | InChI=1S/C18H26O3/c1-3-4-5-6-7-10-15-21-18(19)14-13-16-11-8-9-12-17(16)20-2/h8-9,11-14H,3-7,10,15H2,1-2H3/b14-13+ |
| InChIKey | IISAXLAWYUMIMM-BUHFOSPRSA-N |
| Mol Weight | 290.4 g/mol |
| Molecular Formula | C18H26O3 |
| Exact Mass | 290.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AJqaUs7jxjH |
|---|---|
| Name | Trans-2-methoxycinnamic acid, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.188194694 u |
| Formula | C18H26O3 |
| InChI | InChI=1S/C18H26O3/c1-3-4-5-6-7-10-15-21-18(19)14-13-16-11-8-9-12-17(16)20-2/h8-9,11-14H,3-7,10,15H2,1-2H3/b14-13+ |
| InChIKey | IISAXLAWYUMIMM-BUHFOSPRSA-N |
| Molecular Weight | 290.403 g/mol |
| SMILES | C(OCCCCCCCC)(=O)\C=C\C1=C(OC)C=CC=C1 |