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#(R(P),R(P))-23C*BH3;DI-TERT.-BUTYL-3,3'-[ETHANE-1,2-DIYLBIS-(BORANATOPHENYLPHOSPHANEDIYL)]-BIS-[(1S,2R,3S)-6,6-DIMETHYLBICYCLO-[3.1.1]-HEPTANE-2-CARBOXYLATE]
SpectraBase Compound ID n51ea68yoU
InChI InChI=1S/C42H68B2O4P2/c1-39(2,3)47-37(45)35-31-23-27(41(31,7)8)25-33(35)49(43,29-17-13-11-14-18-29)21-22-50(44,30-19-15-12-16-20-30)34-26-28-24-32(42(28,9)10)36(34)38(46)48-40(4,5)6/h11-20,27-28,31-36,49-50H,21-26H2,1-10,43-44H3/t27-,28+,31+,32-,33+,34-,35+,36-
InChIKey IJKQDADCYDOCKV-RTCDSUJNSA-N
Mol Weight 720.6 g/mol
Molecular Formula C42H68B2O4P2
Exact Mass 720.477895 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FoSCWlRHWga
Name #(R(P),R(P))-23C*BH3;DI-TERT.-BUTYL-3,3'-[ETHANE-1,2-DIYLBIS-(BORANATOPHENYLPHOSPHANEDIYL)]-BIS-[(1S,2R,3S)-6,6-DIMETHYLBICYCLO-[3.1.1]-HEPTANE-2-CARBOXYLATE]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H66B2O4P2
InChI InChI=1S/C42H68B2O4P2/c1-39(2,3)47-37(45)35-31-23-27(41(31,7)8)25-33(35)49(43,29-17-13-11-14-18-29)21-22-50(44,30-19-15-12-16-20-30)34-26-28-24-32(42(28,9)10)36(34)38(46)48-40(4,5)6/h11-20,27-28,31-36,49-50H,21-26H2,1-10,43-44H3/t27-,28+,31+,32-,33+,34-,35+,36-
InChIKey IJKQDADCYDOCKV-RTCDSUJNSA-N
Literature Reference Author B.WIESE,G.KNUEHL,D.FLUBACHER,J.W.PRIESS,B.ULRIKSEN,K.BROEDNE R,G.HELMCHEN
Literature Reference Citation EUR.J.ORG.CHEM.,3246(2005)
Solvent CDCl3
Source File Reference UWSI29935