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2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S,5S)-4-METHYL-3-(4-METHOXYBENZENESULFONYL)-5-PHENYL-1,3-OXAZOLIDINYL]-BIPHENYL

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2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S,5S)-4-METHYL-3-(4-METHOXYBENZENESULFONYL)-5-PHENYL-1,3-OXAZOLIDINYL]-BIPHENYL
SpectraBase Compound ID CiCkIhjqaWY
InChI InChI=1S/C58H64N2O12S2/c1-35-51(39-19-15-13-16-20-39)71-55(59(35)73(63,64)45-27-23-43(67-11)24-28-45)49-33-41(57(5,6)7)31-47(53(49)69-37(3)61)48-32-42(58(8,9)10)34-50(54(48)70-38(4)62)56-60(36(2)52(72-56)40-21-17-14-18-22-40)74(65,66)46-29-25-44(68-12)26-30-46/h13-36,51-52,55-56H,1-12H3/t35-,36-,51+,52+,55-,56-/m0/s1
InChIKey MPCPVUDMOVAFEG-LVGYKETMSA-N
Mol Weight 1045.3 g/mol
Molecular Formula C58H64N2O12S2
Exact Mass 1044.390068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID mCXHmarLKk
Name 2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S,5S)-4-METHYL-3-(4-METHOXYBENZENESULFONYL)-5-PHENYL-1,3-OXAZOLIDINYL]-BIPHENYL
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H64N2O12S2
InChI InChI=1S/C58H64N2O12S2/c1-35-51(39-19-15-13-16-20-39)71-55(59(35)73(63,64)45-27-23-43(67-11)24-28-45)49-33-41(57(5,6)7)31-47(53(49)69-37(3)61)48-32-42(58(8,9)10)34-50(54(48)70-38(4)62)56-60(36(2)52(72-56)40-21-17-14-18-22-40)74(65,66)46-29-25-44(68-12)26-30-46/h13-36,51-52,55-56H,1-12H3/t35-,36-,51+,52+,55-,56-/m0/s1
InChIKey MPCPVUDMOVAFEG-LVGYKETMSA-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 1045.272 g/mol
Sample ID 59130
Solvent CDCl3