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(R(P))-METHYL-(1S,2R,3S)-3-[BORANATOBIPHENYL-2-YL-(PHENYL)-PHOSPHANYL]-6,6-DIMETHYLBICYCLO-[3.1.1]-HEPTANE-2-CARBOXYLATE
SpectraBase Compound ID 7zq7C3nGq7K
InChI InChI=1S/2C29H35BO2P/c2*1-29(2)21-18-24(29)27(28(31)32-3)26(19-21)33(30,22-14-8-5-9-15-22)25-17-11-10-16-23(25)20-12-6-4-7-13-20/h2*4-17,21,24,26-27,33H,18-19H2,1-3,30H3/t2*21-,24+,26+,27+/m11/s1
InChIKey NUJAWYDJYQSRPU-XDYHAMDLSA-N
Mol Weight 914.8 g/mol
Molecular Formula C58H70B2O4P2
Exact Mass 914.493545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3hCi4oHNddk
Name (R(P))-METHYL-(1S,2R,3S)-3-[BORANATOBIPHENYL-2-YL-(PHENYL)-PHOSPHANYL]-6,6-DIMETHYLBICYCLO-[3.1.1]-HEPTANE-2-CARBOXYLATE
Compound Number 18*BH3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H68B2O4P2
InChI InChI=1S/2C29H35BO2P/c2*1-29(2)21-18-24(29)27(28(31)32-3)26(19-21)33(30,22-14-8-5-9-15-22)25-17-11-10-16-23(25)20-12-6-4-7-13-20/h2*4-17,21,24,26-27,33H,18-19H2,1-3,30H3/t2*21-,24+,26+,27+/m11/s1
InChIKey NUJAWYDJYQSRPU-XDYHAMDLSA-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)
Molecular Weight 912.743 g/mol
Sample ID 29928
Solvent CDCl3