![4-[TRIS-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL]-BENZENE-BORONIC-ACID](/api/spectrum/9AvXUwgiZq7/structure.png?h=300&w=458 "4-[TRIS-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL]-BENZENE-BORONIC-ACID")
| SpectraBase Compound ID | H32QmR4igLX |
|---|---|
| InChI | InChI=1S/C54H77BO7/c1-48(2,3)32-51(10,11)40-18-26-44(27-19-40)59-35-54(38-62-47(56)39-16-24-43(25-17-39)55(57)58,36-60-45-28-20-41(21-29-45)52(12,13)33-49(4,5)6)37-61-46-30-22-42(23-31-46)53(14,15)34-50(7,8)9/h16-31,57-58H,32-38H2,1-15H3 |
| InChIKey | LZFOKZKPTSXKTN-UHFFFAOYSA-N |
| Mol Weight | 849.0 g/mol |
| Molecular Formula | C54H77BO7 |
| Exact Mass | 848.576235 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9AvXUwgiZq7 |
|---|---|
| Name | 4-[TRIS-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL]-BENZENE-BORONIC-ACID |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H77BO7 |
| InChI | InChI=1S/C54H77BO7/c1-48(2,3)32-51(10,11)40-18-26-44(27-19-40)59-35-54(38-62-47(56)39-16-24-43(25-17-39)55(57)58,36-60-45-28-20-41(21-29-45)52(12,13)33-49(4,5)6)37-61-46-30-22-42(23-31-46)53(14,15)34-50(7,8)9/h16-31,57-58H,32-38H2,1-15H3 |
| InChIKey | LZFOKZKPTSXKTN-UHFFFAOYSA-N |
| Literature Reference Author | S.P.DRAFFIN,P.J.DUGGAN,S.A.M.DUGGAN |
| Literature Reference Citation | ORG.LETTERS,3,917(2001) |
| Literature Reference DOI | 10.1021/ol015560x |
| Molecular Weight | 849.011 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU33757 |