![2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S)-3-(4-METHYLBENZENESULFONYL)-4-[(1S)-1-METHYLPROPYL)-1,3-OXAZOLIDINYL]-BIPHENYL](/api/spectrum/1M7xG8bq5MQ/structure.png?h=300&w=458 "2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S)-3-(4-METHYLBENZENESULFONYL)-4-[(1S)-1-METHYLPROPYL)-1,3-OXAZOLIDINYL]-BIPHENYL")
| SpectraBase Compound ID | CKJnD8Crezy |
|---|---|
| InChI | InChI=1S/C52H68N2O10S2/c1-15-33(5)45-29-61-49(53(45)65(57,58)39-21-17-31(3)18-22-39)43-27-37(51(9,10)11)25-41(47(43)63-35(7)55)42-26-38(52(12,13)14)28-44(48(42)64-36(8)56)50-54(46(30-62-50)34(6)16-2)66(59,60)40-23-19-32(4)20-24-40/h17-28,33-34,45-46,49-50H,15-16,29-30H2,1-14H3/t33-,34-,45+,46+,49-,50-/m0/s1 |
| InChIKey | FKUWSJVHLNASFS-KQSOPIKPSA-N |
| Mol Weight | 945.2 g/mol |
| Molecular Formula | C52H68N2O10S2 |
| Exact Mass | 944.431539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1M7xG8bq5MQ |
|---|---|
| Name | 2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S)-3-(4-METHYLBENZENESULFONYL)-4-[(1S)-1-METHYLPROPYL)-1,3-OXAZOLIDINYL]-BIPHENYL |
| Compound Number | 7C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H68N2O10S2 |
| InChI | InChI=1S/C52H68N2O10S2/c1-15-33(5)45-29-61-49(53(45)65(57,58)39-21-17-31(3)18-22-39)43-27-37(51(9,10)11)25-41(47(43)63-35(7)55)42-26-38(52(12,13)14)28-44(48(42)64-36(8)56)50-54(46(30-62-50)34(6)16-2)66(59,60)40-23-19-32(4)20-24-40/h17-28,33-34,45-46,49-50H,15-16,29-30H2,1-14H3/t33-,34-,45+,46+,49-,50-/m0/s1 |
| InChIKey | FKUWSJVHLNASFS-KQSOPIKPSA-N |
| Literature Reference Author | S.WUNNEMANN,R.FROEHLICH,D.HOPPE |
| Literature Reference Citation | ORG.LETTERS,8,2455(2006) |
| Literature Reference DOI | 10.1021/ol060528u |
| Molecular Weight | 945.239 g/mol |
| Sample ID | 59128 |
| Solvent | CDCl3 |