| SpectraBase Compound ID | J46ZaUD1UqN |
|---|---|
| InChI | InChI=1S/C30H60O7Si5/c1-38(2,3)32-23-26-27(35-40(7,8)9)28(36-41(10,11)12)29(37-42(13,14)15)30(33-26)31-22-16-17-24-18-20-25(21-19-24)34-39(4,5)6/h16-21,26-30H,22-23H2,1-15H3/b17-16+/t26-,27-,28+,29-,30-/m1/s1 |
| InChIKey | OBVNXDICXJGZNZ-NMPINVEUSA-N |
| Mol Weight | 673.2 g/mol |
| Molecular Formula | C30H60O7Si5 |
| Exact Mass | 672.318537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G8wUiIvr1g2 |
|---|---|
| Name | Triandrin, 5tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 672.318536940 u |
| Formula | C30H60O7Si5 |
| InChI | InChI=1S/C30H60O7Si5/c1-38(2,3)32-23-26-27(35-40(7,8)9)28(36-41(10,11)12)29(37-42(13,14)15)30(33-26)31-22-16-17-24-18-20-25(21-19-24)34-39(4,5)6/h16-21,26-30H,22-23H2,1-15H3/b17-16+/t26-,27-,28+,29-,30-/m1/s1 |
| InChIKey | OBVNXDICXJGZNZ-NMPINVEUSA-N |
| Molecular Weight | 673.228 g/mol |
| SMILES | C[Si](C)(C)OC1=CC=C(\C=C\CO[C@@]2(O[C@](CO[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@](O[Si](C)(C)C)([C@]2(O[Si](C)(C)C)[H])[H])[H])[H])[H])C=C1 |