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Iron 1,3,5-trimethyl-5-(1,3,5-trimethylcyclohexa-2,4-dien-1-yl)cyclohexa-1,3-diene hexacarbonyl
SpectraBase Compound ID Ggku4B37kED
InChI InChI=1S/C18H26.6CO.2Fe/c1-13-7-14(2)10-17(5,9-13)18(6)11-15(3)8-16(4)12-18;6*1-2;;/h7-9,11H,10,12H2,1-6H3;;;;;;;;
InChIKey XQEWSRCOKVPFCU-UHFFFAOYSA-N
Mol Weight 522.156 g/mol
Molecular Formula C24H26Fe2O6
Exact Mass 522.042811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OSwL8IvVcj
Name Iron 1,3,5-trimethyl-5-(1,3,5-trimethylcyclohexa-2,4-dien-1-yl)cyclohexa-1,3-diene hexacarbonyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26Fe2O6
InChI InChI=1S/C18H26.6CO.2Fe/c1-13-7-14(2)10-17(5,9-13)18(6)11-15(3)8-16(4)12-18;6*1-2;;/h7-9,11H,10,12H2,1-6H3;;;;;;;;
InChIKey XQEWSRCOKVPFCU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19901230521
Molecular Weight 522.156 g/mol
SMILES [C-]#[O+].C1(C2(C)C=C(C)C=C(C2)C)(C)C=C(C)C=C(C1)C.[Fe].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[C-]#[O+].[C-]#[O+]
SPLASH splash10-0059-0980000000-2f7c0ebdd5044b95efd0
Source of Spectrum K-123-1075-17
Wiley ID 1792109