| SpectraBase Compound ID | C9WBSXtW2yR |
|---|---|
| InChI | InChI=1S/C40H77NO9Si2/c1-26(2)52(27(3)4,28(5)6)48-25-29(7)23-32(46-15)36(50-51(17,18)40(12,13)14)33(47-16)24-30(8)34(42)35(43)37(44)41-22-20-19-21-31(41)38(45)49-39(9,10)11/h26-33,36H,19-25H2,1-18H3/t29?,30-,31+,32+,33+,36-/m1/s1 |
| InChIKey | NMAADUPEVBDKJH-UZPPNQSSSA-N |
| Mol Weight | 772.2 g/mol |
| Molecular Formula | C40H77NO9Si2 |
| Exact Mass | 771.513686 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7sENNSOiTES |
|---|---|
| Name | MAJOR-ROTAMER |
| Compound Number | 79 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H77NO9Si2 |
| InChI | InChI=1S/C40H77NO9Si2/c1-26(2)52(27(3)4,28(5)6)48-25-29(7)23-32(46-15)36(50-51(17,18)40(12,13)14)33(47-16)24-30(8)34(42)35(43)37(44)41-22-20-19-21-31(41)38(45)49-39(9,10)11/h26-33,36H,19-25H2,1-18H3/t29?,30-,31+,32+,33+,36-/m1/s1 |
| InChIKey | NMAADUPEVBDKJH-UZPPNQSSSA-N |
| Literature Reference Author | T.K.JONES,R.A.REAMER,R.DESMOND,S.G.MILLS |
| Literature Reference Citation | J.AM.CHEM.SOC.,112,2998(1990) |
| Literature Reference DOI | 10.1021/ja00164a023 |
| Molecular Weight | 772.224 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU6581 |