| SpectraBase Compound ID | EhPqrb4VU38 |
|---|---|
| InChI | InChI=1S/C19H20O5/c1-13(20)23-18-12-16(10-9-15-7-5-4-6-8-15)11-17(22-3)19(18)24-14(2)21/h4-8,11-12H,9-10H2,1-3H3 |
| InChIKey | UKWULPWBOKZYEK-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 | IKTvfK0gsB6 |
|---|---|
| Name | 1,2-Benzenediol, 3-methoxy-5-(2-phenylethyl)-, diacetate |
| 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/c1-13(20)23-18-12-16(10-9-15-7-5-4-6-8-15)11-17(22-3)19(18)24-14(2)21/h4-8,11-12H,9-10H2,1-3H3 |
| InChIKey | UKWULPWBOKZYEK-UHFFFAOYSA-N |
| Molecular Weight | 328.364 g/mol |
| SMILES | C=1(C(OC(=O)C)=CC(=CC1OC)CCC=1C=CC=CC1)OC(=O)C |