| SpectraBase Compound ID | 7GnwdgI845v |
|---|---|
| InChI | InChI=1S/C24H48O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(2,3)22-23(25)26-4/h5-22H2,1-4H3 |
| InChIKey | MIGNPNKFHXXZLF-UHFFFAOYSA-N |
| Mol Weight | 368.6 g/mol |
| Molecular Formula | C24H48O2 |
| Exact Mass | 368.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FlK6ncxB3PS |
|---|---|
| Name | Heneicosanoic acid, 3,3-dimethyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.365430784 u |
| Formula | C24H48O2 |
| InChI | InChI=1S/C24H48O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(2,3)22-23(25)26-4/h5-22H2,1-4H3 |
| InChIKey | MIGNPNKFHXXZLF-UHFFFAOYSA-N |
| Molecular Weight | 368.646 g/mol |
| SMILES | C(C(CCCCCCCCCCCCCCCCCC)(C)C)C(OC)=O |