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Iron, [(3,4,5,6-.eta.)-bicyclo[5.1.0]octa-3,5-dien-2-one]tricarbonyl-, stereoisomer
SpectraBase Compound ID 6bfAieX9Pok
InChI InChI=1S/C8H8O.3CO.Fe/c9-8-4-2-1-3-6-5-7(6)8;3*1-2;/h1-4,6-7H,5H2;;;;
InChIKey MFFIHCDYLPPDHK-UHFFFAOYSA-N
Mol Weight 260.03 g/mol
Molecular Formula C11H8FeO4
Exact Mass 259.977195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMIjzX6neKq
Name Iron, [(3,4,5,6-.eta.)-bicyclo[5.1.0]octa-3,5-dien-2-one]tricarbonyl-, stereoisomer
CAS Registry Number 68974-55-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8FeO4
InChI InChI=1S/C8H8O.3CO.Fe/c9-8-4-2-1-3-6-5-7(6)8;3*1-2;/h1-4,6-7H,5H2;;;;
InChIKey MFFIHCDYLPPDHK-UHFFFAOYSA-N
Molecular Weight 260.026 g/mol
SMILES [C@@]12([Fe]34([C@@]2(C(=O)C2C([C@]4([C@@]13[H])[H])C2)[H])(C#[O])(C#[O])C#[O])[H]
SPLASH splash10-0wbd-1930000000-a7dc439721c22a712ecb
Source of Spectrum K-111-3935-0
Synonyms (endo(3-6-.eta.-Bicyclo(5.1.0)octa-3,5-dien-2-on)tricarbonyl)iron Bicyclo[5.1.0]octa-3,5-dien-2-one, iron complex, cis-
Wiley ID 1263207