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(2R,5S)-Tricarbonyl[2-5-.eta.-(2E,4E)-2,4-hexadienayl]iron
SpectraBase Compound ID G8RKlQbkZwU
InChI InChI=1S/C6H8O.3CO.Fe/c1-2-3-4-5-6-7;3*1-2;/h2-6H,1H3;;;;
InChIKey ZZZKAXBPDGNFBN-UHFFFAOYSA-N
Mol Weight 236.0 g/mol
Molecular Formula C9H8FeO4
Exact Mass 235.977195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9RZxgKSwvu
Name (2R,5S)-Tricarbonyl[2-5-.eta.-(2E,4E)-2,4-hexadienayl]iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8FeO4
InChI InChI=1S/C6H8O.3CO.Fe/c1-2-3-4-5-6-7;3*1-2;/h2-6H,1H3;;;;
InChIKey ZZZKAXBPDGNFBN-UHFFFAOYSA-N
Molecular Weight 236.004 g/mol
SMILES C12[Fe]3(C2C=O)(C1C3C)(C#[O])(C#[O])C#[O]
SPLASH splash10-0udi-0910000000-a4c8aebfa22b85bec95d
Source of Spectrum E1-45-1908-2
Synonyms (+)-Tricarbonyl[(2R,5S)-(2,3,4,5-.eta.)hexa-2,4-dienoal]iron 1,1,1-tris(hydroxymethyl)-5-methyl-1-ferratricyclo[2.1.0.0(1,3)]pentane-2-carbaldehyde
Wiley ID 1554160