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(1S,2S)-1,2-[BIS-(3,5-TRIFLUOROMETHYLPHENYL)-PHOSPHINOXY]-CYCLOHEXANE

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(1S,2S)-1,2-[BIS-(3,5-TRIFLUOROMETHYLPHENYL)-PHOSPHINOXY]-CYCLOHEXANE
SpectraBase Compound ID FWrhhT8oIk7
InChI InChI=1S/C38H22F24O2P2/c39-31(40,41)17-5-18(32(42,43)44)10-25(9-17)65(26-11-19(33(45,46)47)6-20(12-26)34(48,49)50)63-29-3-1-2-4-30(29)64-66(27-13-21(35(51,52)53)7-22(14-27)36(54,55)56)28-15-23(37(57,58)59)8-24(16-28)38(60,61)62/h5-16,29-30H,1-4H2/t29-,30-/m1/s1
InChIKey XKSHCNIWRGZUGN-LOYHVIPDSA-N
Mol Weight 1028.5 g/mol
Molecular Formula C38H22F24O2P2
Exact Mass 1028.07118 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kmi0AXov2ys
Name (1S,2S)-1,2-[BIS-(3,5-TRIFLUOROMETHYLPHENYL)-PHOSPHINOXY]-CYCLOHEXANE
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H22F24O2P2
InChI InChI=1S/C38H22F24O2P2/c39-31(40,41)17-5-18(32(42,43)44)10-25(9-17)65(26-11-19(33(45,46)47)6-20(12-26)34(48,49)50)63-29-3-1-2-4-30(29)64-66(27-13-21(35(51,52)53)7-22(14-27)36(54,55)56)28-15-23(37(57,58)59)8-24(16-28)38(60,61)62/h5-16,29-30H,1-4H2/t29-,30-/m1/s1
InChIKey XKSHCNIWRGZUGN-LOYHVIPDSA-N
Literature Reference Author T.V.RAJAN-BABU,B.RADETICH,K.K.YOU,T.A.AYERS,A.L.CASALNUOVO,J .C.CALABRESE
Literature Reference Citation J.ORG.CHEM.,64,3429(1999)
Literature Reference DOI 10.1021/jo9901182
Solvent THF-D8
Source File Reference UWLU58736