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Ferrocene, (2,3,5,6-tetrafluoro-4-methoxyphenyl)-
SpectraBase Compound ID 9kK1oC1LeR1
InChI InChI=1S/C12H7F4O.C5H5.Fe/c1-17-12-10(15)8(13)7(9(14)11(12)16)6-4-2-3-5-6;1-2-4-5-3-1;/h2-5H,1H3;1-5H;/q2*-5;
InChIKey MRBWWIUUEYXCHJ-UHFFFAOYSA-N
Mol Weight 364.12 g/mol
Molecular Formula C17H12F4FeO
Exact Mass 364.017364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AnvWUFWQZZ
Name Ferrocene, (2,3,5,6-tetrafluoro-4-methoxyphenyl)-
Alternate Name(s) 1-(2,3,5,6-tetrafluoro-4-methoxyphenyl)cyclopentane-1,2,3,4,5-pentaide cyclopentane-1,2,3,4,5-pentaide iron p-Methoxytetrafluorophenylferrocene
CAS Registry Number 55334-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12F4FeO
InChI InChI=1S/C12H7F4O.C5H5.Fe/c1-17-12-10(15)8(13)7(9(14)11(12)16)6-4-2-3-5-6;1-2-4-5-3-1;/h2-5H,1H3;1-5H;/q2*-5;
InChIKey MRBWWIUUEYXCHJ-UHFFFAOYSA-N
Molecular Weight 364.121 g/mol
SMILES COc1c(F)c(F)c([C-]2[CH-][CH-][CH-][CH-]2)c(F)c1F.[Fe].[CH-]1[CH-][CH-][CH-][CH-]1
SPLASH splash10-03k9-1409000000-ab54ea8bec7b82588d84
Source of Spectrum O-2-9987-0
Wiley ID 1350594