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(+/-)-TRICARBONYL-[(1,2,3,4,5-ETA)-1-(3',4'-DIMETHOXYPHENYL)-4-METHOXY-2,4-CYCLOHEXADIENYL]-IRON-TETRAFLUOROBORATE
SpectraBase Compound ID 5gI2g8zAm7j
InChI InChI=1S/C15H14O3.3CO.BF4.Fe/c1-16-13-7-4-11(5-8-13)12-6-9-14(17-2)15(10-12)18-3;3*1-2;2-1(3,4)5;/h6,9-10H,4H2,1-3H3;;;;;/q;;;;-1;+1
InChIKey OYYHYKGIQKTDHD-UHFFFAOYSA-N
Mol Weight 468.95 g/mol
Molecular Formula C18H14BF4FeO6
Exact Mass 469.016892 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IzjRjAMyRvJ
Name (+/-)-TRICARBONYL-[(1,2,3,4,5-ETA)-1-(3',4'-DIMETHOXYPHENYL)-4-METHOXY-2,4-CYCLOHEXADIENYL]-IRON-TETRAFLUOROBORATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14BF4FeO6
InChI InChI=1S/C15H14O3.3CO.BF4.Fe/c1-16-13-7-4-11(5-8-13)12-6-9-14(17-2)15(10-12)18-3;3*1-2;2-1(3,4)5;/h6,9-10H,4H2,1-3H3;;;;;/q;;;;-1;+1
InChIKey OYYHYKGIQKTDHD-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 468.956 g/mol
Solvent ACETONE-D6
Source File Reference UWLU84048