| SpectraBase Compound ID | L8iEqV5mnFS |
|---|---|
| InChI | InChI=1S/C20H36O3/c1-3-23-19(22)20(2)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18(20)21/h3-17H2,1-2H3 |
| InChIKey | FFEJJVMARHOKAZ-UHFFFAOYSA-N |
| Mol Weight | 324.5 g/mol |
| Molecular Formula | C20H36O3 |
| Exact Mass | 324.266445 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EqVjKampjGX |
|---|---|
| Name | 2-(Ethoxycarbonyl)-2-methylcyclohexadecanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.266445016 u |
| Formula | C20H36O3 |
| InChI | InChI=1S/C20H36O3/c1-3-23-19(22)20(2)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18(20)21/h3-17H2,1-2H3 |
| InChIKey | FFEJJVMARHOKAZ-UHFFFAOYSA-N |
| Molecular Weight | 324.505 g/mol |
| SMILES | C1(C(CCCCCCCCCCCCCC1)(C)C(=O)OCC)=O |