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bis(S-Ferrocenyl) ferrocene-di(monothiocarboxylate)
SpectraBase Compound ID AlXQF9xIXKJ
InChI InChI=1S/2C11H8OS.2C5H5.3Fe/c2*12-11(9-5-1-2-6-9)13-10-7-3-4-8-10;2*1-2-4-5-3-1;;;/h2*1-8H;2*1-5H;;;
InChIKey HVXFOIRGOGNBLE-UHFFFAOYSA-N
Mol Weight 674.2 g/mol
Molecular Formula C32H26Fe3O2S2
Exact Mass 673.94223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87fRA0cuQeP
Name bis(S-Ferrocenyl) ferrocene-di(monothiocarboxylate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H26Fe3O2S2
InChI InChI=1S/2C11H8OS.2C5H5.3Fe/c2*12-11(9-5-1-2-6-9)13-10-7-3-4-8-10;2*1-2-4-5-3-1;;;/h2*1-8H;2*1-5H;;;
InChIKey HVXFOIRGOGNBLE-UHFFFAOYSA-N
Molecular Weight 674.214 g/mol
SMILES C12([Fe]3456789(C2C5C4C13)C1(C(SC23[Fe]45%10%11%12%13%14(C%15C%14C%13C%12C%11%15)C3C%10C5C24)=O)C9C8C7C61)C(SC12[Fe]3456789(C%10C5C7C6C3%10)C2C9C4C18)=O
SPLASH splash10-01b9-0090207000-e1b44f08d7cb71a33ef1
Source of Spectrum AG-556-173-0
Wiley ID 1414090