| SpectraBase Compound ID | HEmH0ybnqg3 |
|---|---|
| InChI | InChI=1S/C28H58O7Si5/c1-21-17-22(19-23(18-21)32-37(5,6)7)30-28-27(35-40(14,15)16)26(34-39(11,12)13)25(33-38(8,9)10)24(31-28)20-29-36(2,3)4/h17-19,24-28H,20H2,1-16H3/t24-,25-,26+,27-,28-/m1/s1 |
| InChIKey | KOLULHXGIBKIER-RKFAPSRVSA-N |
| Mol Weight | 647.2 g/mol |
| Molecular Formula | C28H58O7Si5 |
| Exact Mass | 646.302887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LVmPfazFzmf |
|---|---|
| Name | Orcinol .beta.-D-glucoside, 5tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 646.302886876 u |
| Formula | C28H58O7Si5 |
| InChI | InChI=1S/C28H58O7Si5/c1-21-17-22(19-23(18-21)32-37(5,6)7)30-28-27(35-40(14,15)16)26(34-39(11,12)13)25(33-38(8,9)10)24(31-28)20-29-36(2,3)4/h17-19,24-28H,20H2,1-16H3/t24-,25-,26+,27-,28-/m1/s1 |
| InChIKey | KOLULHXGIBKIER-RKFAPSRVSA-N |
| SMILES | C1(=CC(O[Si](C)(C)C)=CC(=C1)C)O[C@]1([C@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@](O[Si](C)(C)C)([C@](O1)(CO[Si](C)(C)C)[H])[H])[H])[H])[H] |