| SpectraBase Compound ID | J1pRtIURV9N |
|---|---|
| InChI | InChI=1S/C25H54OSi/c1-6-8-10-12-14-15-16-17-18-20-22-24-25(26-27(3,4)5)23-21-19-13-11-9-7-2/h25H,6-24H2,1-5H3 |
| InChIKey | ADPUIWDVHGXRLK-UHFFFAOYSA-N |
| Mol Weight | 398.8 g/mol |
| Molecular Formula | C25H54OSi |
| Exact Mass | 398.394393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5MaQXaYCCt |
|---|---|
| Name | Docosan-9-ol, o-tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 398.394392893 u |
| Formula | C25H54OSi |
| InChI | InChI=1S/C25H54OSi/c1-6-8-10-12-14-15-16-17-18-20-22-24-25(26-27(3,4)5)23-21-19-13-11-9-7-2/h25H,6-24H2,1-5H3 |
| InChIKey | ADPUIWDVHGXRLK-UHFFFAOYSA-N |
| Molecular Weight | 398.791 g/mol |
| SMILES | C[Si](C)(C)OC(CCCCCCCCCCCCC)CCCCCCCC |