| SpectraBase Compound ID | ElblbJetRD6 |
|---|---|
| InChI | InChI=1S/C28H60OSi/c1-6-8-10-12-14-16-17-18-19-21-23-25-27-28(29-30(3,4)5)26-24-22-20-15-13-11-9-7-2/h28H,6-27H2,1-5H3 |
| InChIKey | CDPUJZZVLYYFHC-UHFFFAOYSA-N |
| Mol Weight | 440.9 g/mol |
| Molecular Formula | C28H60OSi |
| Exact Mass | 440.441343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EwTmMTv7IBD |
|---|---|
| Name | Pentacosan-11-ol, o-tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 440.441343086 u |
| Formula | C28H60OSi |
| InChI | InChI=1S/C28H60OSi/c1-6-8-10-12-14-16-17-18-19-21-23-25-27-28(29-30(3,4)5)26-24-22-20-15-13-11-9-7-2/h28H,6-27H2,1-5H3 |
| InChIKey | CDPUJZZVLYYFHC-UHFFFAOYSA-N |
| Molecular Weight | 440.872 g/mol |
| SMILES | C[Si](C)(C)OC(CCCCCCCCCCCCCC)CCCCCCCCCC |