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[PD-(S-(-)-BINAP)-(H2O)]-[OTF]2

View entire compound with spectra: 2 NMR

[PD-(S-(-)-BINAP)-(H2O)]-[OTF]2
SpectraBase Compound ID JA1JSxRo5uC
InChI InChI=1S/C44H32P2.2CHF3O3S.H2O.Pd/c1-5-19-35(20-6-1)45(36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)46(37-23-9-3-10-24-37)38-25-11-4-12-26-38;2*2-1(3,4)8(5,6)7;;/h1-32H;2*(H,5,6,7);1H2;
InChIKey JVZQRLIUMMHZTN-UHFFFAOYSA-N
Mol Weight 1047.3 g/mol
Molecular Formula C46H36F6O7P2PdS2
Exact Mass 1046.031669 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9KKisDwMvO
Name [PD-(S-(-)-BINAP)-(H2O)]-[OTF]2
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H34F6O7P2PdS2
InChI InChI=1S/C44H32P2.2CHF3O3S.H2O.Pd/c1-5-19-35(20-6-1)45(36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)46(37-23-9-3-10-24-37)38-25-11-4-12-26-38;2*2-1(3,4)8(5,6)7;;/h1-32H;2*(H,5,6,7);1H2;
InChIKey JVZQRLIUMMHZTN-UHFFFAOYSA-N
Literature Reference Author B.OLENYUK,J.A.WHITEFORD,P.J.STANG
Literature Reference Citation J.AM.CHEM.SOC.,118,8221(1996)
Literature Reference DOI 10.1021/ja961444r
Solvent CD2Cl2
Source File Reference UWLU45867