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2,10-DI-TERT.-BUTYL-4,8-BIS-[(2R,4R)-4-ETHYL-3-(4-METHYLBENZENESULFONYL)-1,3-OXAZOLIDINYL]-2-PHENOXY-DIBENZO-[D,F]-[1,3,2]-DIOXAPHOSPHEPINE
SpectraBase Compound ID EbHfIU4F0dh
InChI InChI=1S/C50H59N2O9PS2/c1-11-36-30-57-47(51(36)63(53,54)39-22-18-32(3)19-23-39)43-28-34(49(5,6)7)26-41-42-27-35(50(8,9)10)29-44(46(42)61-62(60-45(41)43)59-38-16-14-13-15-17-38)48-52(37(12-2)31-58-48)64(55,56)40-24-20-33(4)21-25-40/h13-29,36-37,47-48H,11-12,30-31H2,1-10H3/t36-,37-,47-,48-/m1/s1
InChIKey ZNBOWJLGCGDTDV-TZSAAMIFSA-N
Mol Weight 927.1 g/mol
Molecular Formula C50H59N2O9PS2
Exact Mass 926.339961 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SsO5ncX0T3
Name 2,10-DI-TERT.-BUTYL-4,8-BIS-[(2R,4R)-4-ETHYL-3-(4-METHYLBENZENESULFONYL)-1,3-OXAZOLIDINYL]-2-PHENOXY-DIBENZO-[D,F]-[1,3,2]-DIOXAPHOSPHEPINE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H59N2O9PS2
InChI InChI=1S/C50H59N2O9PS2/c1-11-36-30-57-47(51(36)63(53,54)39-22-18-32(3)19-23-39)43-28-34(49(5,6)7)26-41-42-27-35(50(8,9)10)29-44(46(42)61-62(60-45(41)43)59-38-16-14-13-15-17-38)48-52(37(12-2)31-58-48)64(55,56)40-24-20-33(4)21-25-40/h13-29,36-37,47-48H,11-12,30-31H2,1-10H3/t36-,37-,47-,48-/m1/s1
InChIKey ZNBOWJLGCGDTDV-TZSAAMIFSA-N
Literature Reference Author S.WUNNEMANN,R.FROEHLICH,D.HOPPE
Literature Reference Citation ORG.LETTERS,8,2455(2006)
Literature Reference DOI 10.1021/ol060528u
Solvent CDCl3
Source File Reference UWLU59138