| SpectraBase Compound ID | 9NGalxnWoJK |
|---|---|
| InChI | InChI=1S/C33H58OSi/c1-25(13-11-14-26(2)20-24-34-35(8,9)10)15-17-28-27(3)16-18-30-32(28,6)23-19-29-31(4,5)21-12-22-33(29,30)7/h13,16,20,28-30H,11-12,14-15,17-19,21-24H2,1-10H3/b25-13+,26-20+/t28-,29+,30+,32+,33+/m0/s1 |
| InChIKey | WFZADZXKGYSZTP-PHFSEBHKSA-N |
| Mol Weight | 498.9 g/mol |
| Molecular Formula | C33H58OSi |
| Exact Mass | 498.425693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7piSWQ0BtoH |
|---|---|
| Name | Tricyclohexaprenol-trimethylsiilyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 498.425693022 u |
| Formula | C33H58OSi |
| InChI | InChI=1S/C33H58OSi/c1-25(13-11-14-26(2)20-24-34-35(8,9)10)15-17-28-27(3)16-18-30-32(28,6)23-19-29-31(4,5)21-12-22-33(29,30)7/h13,16,20,28-30H,11-12,14-15,17-19,21-24H2,1-10H3/b25-13+,26-20+/t28-,29+,30+,32+,33+/m0/s1 |
| InChIKey | WFZADZXKGYSZTP-PHFSEBHKSA-N |
| Molecular Weight | 498.911 g/mol |
| SMILES | [C@]12([C@]([C@]3([C@](C(CCC3)(C)C)([H])CC1)C)(CC=C([C@@]2(CC\C(=C\CC\C(=C\CO[Si](C)(C)C)C)C)[H])C)[H])C |