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[TRANS-(SPANPHOS)PDC(O)CH3]-[CF3SO3]

View entire compound with spectra: 1 NMR

[TRANS-(SPANPHOS)PDC(O)CH3]-[CF3SO3]
SpectraBase Compound ID E3FX4Udw595
InChI InChI=1S/C45H42O2P2.C2H3O.CHF3O3S.Pd/c1-43(2)31-45(46-41-37(43)27-17-29-39(41)48(33-19-9-5-10-20-33)34-21-11-6-12-22-34)32-44(3,4)38-28-18-30-40(42(38)47-45)49(35-23-13-7-14-24-35)36-25-15-8-16-26-36;1-2-3;2-1(3,4)8(5,6)7;/h5-30H,31-32H2,1-4H3;1H3;(H,5,6,7);/q;;;-1/p+1
InChIKey QZSSYMNZPNSDKI-UHFFFAOYSA-O
Mol Weight 977.32 g/mol
Molecular Formula C48H47F3O6P2PdS
Exact Mass 976.155549 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G6cWJAWaEpc
Name [TRANS-(SPANPHOS)PDC(O)CH3]-[CF3SO3]
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H45F3O6P2PdS
InChI InChI=1S/C45H42O2P2.C2H3O.CHF3O3S.Pd/c1-43(2)31-45(46-41-37(43)27-17-29-39(41)48(33-19-9-5-10-20-33)34-21-11-6-12-22-34)32-44(3,4)38-28-18-30-40(42(38)47-45)49(35-23-13-7-14-24-35)36-25-15-8-16-26-36;1-2-3;2-1(3,4)8(5,6)7;/h5-30H,31-32H2,1-4H3;1H3;(H,5,6,7);/q;;;-1/p+1
InChIKey QZSSYMNZPNSDKI-UHFFFAOYSA-O
Literature Reference Author P.W.N.M.V.LEEUWEN,M.A.ZUIDEVELD,B.H.G.SWENNENHUIS,Z.FREIXA,P .C.J.KAMER,K.GOUBITZ
Literature Reference Citation J.AM.CHEM.SOC.,125,5523(2003)
Literature Reference DOI 10.1021/ja029341y
Solvent CD2Cl2
Source File Reference UWLU41020