| SpectraBase Compound ID | 3vPkJ18KZXN |
|---|---|
| InChI | InChI=1S/C21H40O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h5-11,14-20H2,1-4H3 |
| InChIKey | BUGFUJXFXZEVIV-UHFFFAOYSA-N |
| Mol Weight | 352.6 g/mol |
| Molecular Formula | C21H40O2Si |
| Exact Mass | 352.279757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7qlqzA3pai2 |
|---|---|
| Name | Stearolic acid, tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.279757061 u |
| Formula | C21H40O2Si |
| InChI | InChI=1S/C21H40O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h5-11,14-20H2,1-4H3 |
| InChIKey | BUGFUJXFXZEVIV-UHFFFAOYSA-N |
| Molecular Weight | 352.634 g/mol |
| SMILES | C(CCCCCCCC#CCCCCCCCC)(=O)O[Si](C)(C)C |