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(+/-)-TRICARBONYL-[(1,2,3,4,5-ETA)-1-(3',4'-DIMETHOXYPHENYL)-4-METHOXY-2,4-CYCLOHEXADIENYL]-IRON-HEXAFLUOROPHOSPHATE
SpectraBase Compound ID Fk0g12Y0wbY
InChI InChI=1S/C15H14O3.3CO.F6P.Fe/c1-16-13-7-4-11(5-8-13)12-6-9-14(17-2)15(10-12)18-3;3*1-2;1-7(2,3,4,5)6;/h6,9-10H,4H2,1-3H3;;;;;/q;;;;-1;+1
InChIKey GUBLDCUAAGFSFI-UHFFFAOYSA-N
Mol Weight 527.11 g/mol
Molecular Formula C18H14F6FeO6P
Exact Mass 526.978155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BoKNuD7HUK0
Name (+/-)-TRICARBONYL-[(1,2,3,4,5-ETA)-1-(3',4'-DIMETHOXYPHENYL)-4-METHOXY-2,4-CYCLOHEXADIENYL]-IRON-HEXAFLUOROPHOSPHATE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14F6FeO6P
InChI InChI=1S/C15H14O3.3CO.F6P.Fe/c1-16-13-7-4-11(5-8-13)12-6-9-14(17-2)15(10-12)18-3;3*1-2;1-7(2,3,4,5)6;/h6,9-10H,4H2,1-3H3;;;;;/q;;;;-1;+1
InChIKey GUBLDCUAAGFSFI-UHFFFAOYSA-N
Literature Reference Author G.R.STEPHENSON,C.E.ANSON.A.V.MALKOV,C.ROE
Literature Reference Citation EUR.J.ORG.CHEM.,2012,4716(2012)
Literature Reference DOI 10.1002/ejoc.201200687
Molecular Weight 527.117 g/mol
Solvent ACETONE-D6
Source File Reference UWLU84049