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TRICARBONYL-1-5-ETA-(1,3,5-TRIMETHYL-1,3-CYCLOHEXADIEN-5-YL)]-IRON-TETRAFLUOROBORATE
SpectraBase Compound ID I8o5FTHQmfc
InChI InChI=1S/C9H14.3CO.BF4.Fe/c1-7-4-8(2)6-9(3)5-7;3*1-2;2-1(3,4)5;/h4-5,7H,6H2,1-3H3;;;;;/q;;;;-1;
InChIKey OZHZXDNGGDWFIN-UHFFFAOYSA-N
Mol Weight 348.89 g/mol
Molecular Formula C12H14BF4FeO3
Exact Mass 349.032148 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DVpoeHT4fRM
Name TRICARBONYL-1-5-ETA-(1,3,5-TRIMETHYL-1,3-CYCLOHEXADIEN-5-YL)]-IRON-TETRAFLUOROBORATE
Compound Number 16A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14BF4FeO3
InChI InChI=1S/C9H14.3CO.BF4.Fe/c1-7-4-8(2)6-9(3)5-7;3*1-2;2-1(3,4)5;/h4-5,7H,6H2,1-3H3;;;;;/q;;;;-1;
InChIKey OZHZXDNGGDWFIN-UHFFFAOYSA-N
Literature Reference Author P.EILBRACHT,C.HITTINGER,K.KUFFERATH
Literature Reference Citation CHEM.BER.,123,1071(1990)
Literature Reference DOI 10.1002/cber.19901230521
Molecular Weight 348.892 g/mol
Solvent DMSO
Source File Reference UWCS13509