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[Q-PHOS-(PH)](+)-[OTF](-)

View entire compound with spectra: 1 NMR

[Q-PHOS-(PH)](+)-[OTF](-)
SpectraBase Compound ID LDYDWCjYsBM
InChI InChI=1S/C35H25.C13H22P.C6H5.CHF3O3S.Fe/c1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28;1-12(2,3)14(13(4,5)6)11-9-7-8-10-11;1-2-4-6-5-3-1;2-1(3,4)8(5,6)7;/h1-25H;7-9,11H,1-6H3;1-5H;(H,5,6,7);/q;;;;+1/p-1
InChIKey IFSDVUCVRBLHIF-UHFFFAOYSA-M
Mol Weight 936.9 g/mol
Molecular Formula C55H52F3FeO3PS
Exact Mass 936.267624 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EHUjVqzbMxE
Name [Q-PHOS-(PH)](+)-[OTF](-)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C55H52F3FeO3PS
InChI InChI=1S/C35H25.C13H22P.C6H5.CHF3O3S.Fe/c1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28;1-12(2,3)14(13(4,5)6)11-9-7-8-10-11;1-2-4-6-5-3-1;2-1(3,4)8(5,6)7;/h1-25H;7-9,11H,1-6H3;1-5H;(H,5,6,7);/q;;;;+1/p-1
InChIKey IFSDVUCVRBLHIF-UHFFFAOYSA-M
Literature Reference Author J.P.STAMBULI,C.D.INCARVITO,M.BUEHL,J.F.HARTWIG
Literature Reference Citation J.AM.CHEM.SOC.,126,1184(2004)
Literature Reference DOI 10.1021/ja037928m
Solvent CH2Cl2
Source File Reference UWSI28173