| SpectraBase Compound ID | I8PJlMbhmec |
|---|---|
| InChI | InChI=1S/C17H18O3/c1-19-16-12-6-5-11-15(16)17(18)20-13-7-10-14-8-3-2-4-9-14/h2-6,8-9,11-12H,7,10,13H2,1H3 |
| InChIKey | LPFWUOWVVZZDSD-UHFFFAOYSA-N |
| Mol Weight | 270.33 g/mol |
| Molecular Formula | C17H18O3 |
| Exact Mass | 270.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CgWfwiHTpP7 |
|---|---|
| Name | 2-Methoxybenzoic acid, 3-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.125594437 u |
| Formula | C17H18O3 |
| InChI | InChI=1S/C17H18O3/c1-19-16-12-6-5-11-15(16)17(18)20-13-7-10-14-8-3-2-4-9-14/h2-6,8-9,11-12H,7,10,13H2,1H3 |
| InChIKey | LPFWUOWVVZZDSD-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC=C1)CCCOC(C1=C(C=CC=C1)OC)=O |