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2-(Trifluoromethylsulfonyl)ferrocenyl Acetate
SpectraBase Compound ID GpZ4dI5bCZN
InChI InChI=1S/C8H6F3O4S.C5H5.Fe/c1-5(12)15-6-3-2-4-7(6)16(13,14)8(9,10)11;1-2-4-5-3-1;/h2-4H,1H3;1-5H;/q2*-1;+2
InChIKey OGXPPKVLVMYJHZ-UHFFFAOYSA-N
Mol Weight 376.13 g/mol
Molecular Formula C13H11F3FeO4S
Exact Mass 375.96795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mCXzB4eTnR
Name 2-(Trifluoromethylsulfonyl)ferrocenyl Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3FeO4S
InChI InChI=1S/C8H6F3O4S.C5H5.Fe/c1-5(12)15-6-3-2-4-7(6)16(13,14)8(9,10)11;1-2-4-5-3-1;/h2-4H,1H3;1-5H;/q2*-1;+2
InChIKey OGXPPKVLVMYJHZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000068
Molecular Weight 376.127 g/mol
SMILES c1(S(=O)(=O)C(F)(F)F)c([cH-]cc1)OC(C)=O.c1ccc[cH-]1.[Fe+2]
SPLASH splash10-0ff0-4549000000-32381fdf61c3a60eb162
Source of Spectrum ASC-352-1352-11
Synonyms Iron(II) 2-acetoxy-3-((trifluoromethyl)sulfonyl)cyclopenta-2,4-dien-1-ide cyclopenta-2,4-dien-1-ide
Wiley ID 1764475