| SpectraBase Compound ID | 6B0WhgHByWh |
|---|---|
| InChI | InChI=1S/C19H20O5/c1-2-12-23-18(20)16-10-6-7-11-17(16)19(21)24-14-13-22-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3 |
| InChIKey | GAJFBWVSAVIBBK-UHFFFAOYSA-N |
| Mol Weight | 328.36 g/mol |
| Molecular Formula | C19H20O5 |
| Exact Mass | 328.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Fwg9bwjmzX |
|---|---|
| Name | Phthalic acid, 2-phenoxyethyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.131073739 u |
| Formula | C19H20O5 |
| InChI | InChI=1S/C19H20O5/c1-2-12-23-18(20)16-10-6-7-11-17(16)19(21)24-14-13-22-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3 |
| InChIKey | GAJFBWVSAVIBBK-UHFFFAOYSA-N |
| Molecular Weight | 328.364 g/mol |
| SMILES | C(C1=CC=CC=C1C(=O)OCCOC1=CC=CC=C1)(OCCC)=O |