| SpectraBase Compound ID | Le30bMzZIdB |
|---|---|
| InChI | InChI=1S/C20H32O4/c1-5-8-13-22-18-12-11-17(16(4)21)19(23-14-9-6-2)20(18)24-15-10-7-3/h11-12H,5-10,13-15H2,1-4H3 |
| InChIKey | QGJAJFWDJUSFJE-UHFFFAOYSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C20H32O4 |
| Exact Mass | 336.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBE6veuEXdK |
|---|---|
| Name | 2',3',4',-tri(N-Butyl)oxyacetophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.230059506 u |
| Formula | C20H32O4 |
| InChI | InChI=1S/C20H32O4/c1-5-8-13-22-18-12-11-17(16(4)21)19(23-14-9-6-2)20(18)24-15-10-7-3/h11-12H,5-10,13-15H2,1-4H3 |
| InChIKey | QGJAJFWDJUSFJE-UHFFFAOYSA-N |
| Molecular Weight | 336.472 g/mol |
| SMILES | C1=CC(C(C)=O)=C(C(=C1OCCCC)OCCCC)OCCCC |