| SpectraBase Compound ID | 4HSGDToz1Dq |
|---|---|
| InChI | InChI=1S/C22H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)20-18-19-25-22(20)24/h20H,2-19H2,1H3 |
| InChIKey | DHBNKJDUOCTGCK-UHFFFAOYSA-N |
| Mol Weight | 352.6 g/mol |
| Molecular Formula | C22H40O3 |
| Exact Mass | 352.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dfwc3D59fuE |
|---|---|
| Name | Perhydro-2-oxo-3-stearoylfuran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.297745145 u |
| Formula | C22H40O3 |
| InChI | InChI=1S/C22H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)20-18-19-25-22(20)24/h20H,2-19H2,1H3 |
| InChIKey | DHBNKJDUOCTGCK-UHFFFAOYSA-N |
| Molecular Weight | 352.559 g/mol |
| SMILES | C1CC(C(CCCCCCCCCCCCCCCCC)=O)C(O1)=O |