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XEKUURUQXMSNAH-UHFFFAOYSA-L

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XEKUURUQXMSNAH-UHFFFAOYSA-L
SpectraBase Compound ID GjRAD6fj2mT
InChI InChI=1S/C24H36N2O2.CHF3O3S.ClH.Rh/c1-15-9-16(2)18(12-22-26-20(14-28-22)24(6,7)8)10-17(15)11-21-25-19(13-27-21)23(3,4)5;2-1(3,4)8(5,6)7;;/h9-10,19-20H,11-14H2,1-8H3;(H,5,6,7);1H;/q;;;+2/p-2
InChIKey XEKUURUQXMSNAH-UHFFFAOYSA-L
Mol Weight 672.0 g/mol
Molecular Formula C25H36ClF3N2O5RhS
Exact Mass 671.104046 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BcfTbClDtd2
Name XEKUURUQXMSNAH-UHFFFAOYSA-L
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36ClF3N2O5RhS
InChI InChI=1S/C24H36N2O2.CHF3O3S.ClH.Rh/c1-15-9-16(2)18(12-22-26-20(14-28-22)24(6,7)8)10-17(15)11-21-25-19(13-27-21)23(3,4)5;2-1(3,4)8(5,6)7;;/h9-10,19-20H,11-14H2,1-8H3;(H,5,6,7);1H;/q;;;+2/p-2
InChIKey XEKUURUQXMSNAH-UHFFFAOYSA-L
Literature Reference Author J.R.KRUMPER,M.GERISCH,J.M.SUH,R.G.BERGMAN,T.D.TILLEY
Literature Reference Citation J.ORG.CHEM.,68,9705(2003)
Literature Reference DOI 10.1021/jo035120e
Solvent C6D6
Source File Reference UWLU24360