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Iron, tricarbonyl[(2,3,4,5-.eta.)-2,4-cyclohexadien-1-ol]-
SpectraBase Compound ID 24BzVASsiyI
InChI InChI=1S/C6H8O.3CO.Fe/c7-6-4-2-1-3-5-6;3*1-2;/h1-4,6-7H,5H2;;;;
InChIKey QBMHZGGTWYRSDY-UHFFFAOYSA-N
Mol Weight 231.972 g/mol
Molecular Formula C9H4FeO4
Exact Mass 231.945895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DcswefNdAl
Name Iron, tricarbonyl[(2,3,4,5-.eta.)-2,4-cyclohexadien-1-ol]-
Alternate Name(s) 6-Hydroxycyclohexane-1,2,3,4-tetraide tris(methanidylidyneoxidanium) iron Iron, tricarbonyl[(2,3,4,5-eta)-2,4-cyclohexadien-1-ol]- Triacarbonyl-5-hydroxy-cyclohexa-1,3-dieneiron
CAS Registry Number 12306-93-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8FeO4
InChI InChI=1S/C6H8O.3CO.Fe/c7-6-4-2-1-3-5-6;3*1-2;/h1-4,6-7H,5H2;;;;
InChIKey QBMHZGGTWYRSDY-UHFFFAOYSA-N
Molecular Weight 231.972 g/mol
SMILES OC1C[C][C][C][C]1.[O+]#[C-].[O+]#[C-].[O+]#[C-].[Fe]
SPLASH splash10-057i-9510000000-bf4840c59a2c6f2ff61d
Source of Spectrum T-68-1412-0
Wiley ID 31982