| SpectraBase Compound ID | GUwEjiODAk9 |
|---|---|
| InChI | InChI=1S/C23H22O3/c1-2-22(19-11-7-4-8-12-19)23(24)26-21-15-13-20(14-16-21)25-17-18-9-5-3-6-10-18/h3-16,22H,2,17H2,1H3 |
| InChIKey | PIGCRLOQWZAHMD-UHFFFAOYSA-N |
| Mol Weight | 346.43 g/mol |
| Molecular Formula | C23H22O3 |
| Exact Mass | 346.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATBetPrFWtI |
|---|---|
| Name | Butyric acid, 2-phenyl-, 4-benzyloxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.156894565 u |
| Formula | C23H22O3 |
| InChI | InChI=1S/C23H22O3/c1-2-22(19-11-7-4-8-12-19)23(24)26-21-15-13-20(14-16-21)25-17-18-9-5-3-6-10-18/h3-16,22H,2,17H2,1H3 |
| InChIKey | PIGCRLOQWZAHMD-UHFFFAOYSA-N |
| Molecular Weight | 346.426 g/mol |
| SMILES | C(C(C(OC1=CC=C(C=C1)OCC1=CC=CC=C1)=O)C1=CC=CC=C1)C |