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Iron, dicarbonyl(.eta.5-2,4-cyclopentadien-1-yl)[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID KDAyC7GioS2
InChI InChI=1S/C7F7.C5H5.2CO.Fe/c8-2-1-3(9)6(11)4(5(2)10)7(12,13)14;1-2-4-5-3-1;2*1-2;/h;1-5H;;;/q-1;;;;+1
InChIKey VYBHHNCIPVUPBF-UHFFFAOYSA-N
Mol Weight 388.986 g/mol
Molecular Formula C14F7FeO2
Exact Mass 388.913587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlXfq2jJqjR
Name Iron, dicarbonyl(.eta.5-2,4-cyclopentadien-1-yl)[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-
Alternate Name(s) .pi.-cyclopentadienyl-p-heptafluorotolyl-dicarbonyl iron 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzen-1-ide cyclopentane-1,2,3,4,5-pentaide bis(methanidylidyneoxidanium) iron Iron, dicarbonyl(eta5-2,4-cyclopentadien-1-yl)[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-
CAS Registry Number 33010-27-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H5F7FeO2
InChI InChI=1S/C7F7.C5H5.2CO.Fe/c8-2-1-3(9)6(11)4(5(2)10)7(12,13)14;1-2-4-5-3-1;2*1-2;/h;1-5H;;;/q-1;;;;+1
InChIKey VYBHHNCIPVUPBF-UHFFFAOYSA-N
Molecular Weight 388.986 g/mol
SMILES [C]1[C][C][C][C]1.c1(C(F)(F)F)c(c(F)[c-]c(c1F)F)F.[O+]#[C-].[O+]#[C-].[Fe+]
SPLASH splash10-00ku-5953000000-bc23ed1edd14401807d9
Source of Spectrum AD-0-2800-0
Wiley ID 1366407