| SpectraBase Compound ID | 6ZgAjkxiUqn |
|---|---|
| InChI | InChI=1S/C20H22O4/c1-3-5-7-15-10-12-16(13-11-15)20(22)24-18-9-6-8-17(14-18)23-19(21)4-2/h6,8-14H,3-5,7H2,1-2H3 |
| InChIKey | OGVAQEXHQUMUBG-UHFFFAOYSA-N |
| Mol Weight | 326.39 g/mol |
| Molecular Formula | C20H22O4 |
| Exact Mass | 326.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IOOZi4NFngw |
|---|---|
| Name | 1,3-Benzenediol, o-(4-butylbenzoyl)-o'-propionyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.151809184 u |
| Formula | C20H22O4 |
| InChI | InChI=1S/C20H22O4/c1-3-5-7-15-10-12-16(13-11-15)20(22)24-18-9-6-8-17(14-18)23-19(21)4-2/h6,8-14H,3-5,7H2,1-2H3 |
| InChIKey | OGVAQEXHQUMUBG-UHFFFAOYSA-N |
| Molecular Weight | 326.392 g/mol |
| SMILES | C1(=CC(=CC=C1)OC(CC)=O)OC(C1=CC=C(CCCC)C=C1)=O |