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ETA-(6)-FLUOROBENZENEDICARBONYL-[TRI-(2-METHYL-THIO-PYRROLYL)-PHOSPHINE]-CHROMIUM-(0);X=F
SpectraBase Compound ID 2GJ6EF1zgYN
InChI InChI=1S/C15H18N3PS3.C6F.2CO.Cr/c1-20-13-7-4-10-16(13)19(17-11-5-8-14(17)21-2)18-12-6-9-15(18)22-3;7-6-4-2-1-3-5-6;2*1-2;/h4-12H,1-3H3;;;;
InChIKey FYTHKOUWFSAWKD-UHFFFAOYSA-N
Mol Weight 566.56 g/mol
Molecular Formula C23H18CrFN3O2PS3
Exact Mass 565.968786 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6iRiMdCqeQe
Name ETA-(6)-FLUOROBENZENEDICARBONYL-[TRI-(2-METHYL-THIO-PYRROLYL)-PHOSPHINE]-CHROMIUM-(0);X=F
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H18CrFN3O2PS3
InChI InChI=1S/C15H18N3PS3.C6F.2CO.Cr/c1-20-13-7-4-10-16(13)19(17-11-5-8-14(17)21-2)18-12-6-9-15(18)22-3;7-6-4-2-1-3-5-6;2*1-2;/h4-12H,1-3H3;;;;
InChIKey FYTHKOUWFSAWKD-UHFFFAOYSA-N
Literature Reference Author M.F.SEMMELHACK,A.CHLENOV,L.WU,D.HO
Literature Reference Citation J.AM.CHEM.SOC.,123,8438(2001)
Literature Reference DOI 10.1021/ja0161150
Solvent C6D6
Source File Reference UWVN30234