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Tricarbonyl-[ 1,6-bis(isopropyl)cyclohepta-2,4-diene-1,6-diol]-iron
SpectraBase Compound ID Ty7lfMZ0ua
InChI InChI=1S/C13H22O2.3CO.Fe/c1-10(2)12(14)7-5-6-8-13(15,9-12)11(3)4;3*1-2;/h5-8,10-11,14-15H,9H2,1-4H3;;;;
InChIKey IFXUNXIKFSJZPJ-UHFFFAOYSA-N
Mol Weight 350.19 g/mol
Molecular Formula C16H22FeO5
Exact Mass 350.08166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Atr4VB3lFRm
Name Tricarbonyl-[ 1,6-bis(isopropyl)cyclohepta-2,4-diene-1,6-diol]-iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22FeO5
InChI InChI=1S/C13H22O2.3CO.Fe/c1-10(2)12(14)7-5-6-8-13(15,9-12)11(3)4;3*1-2;/h5-8,10-11,14-15H,9H2,1-4H3;;;;
InChIKey IFXUNXIKFSJZPJ-UHFFFAOYSA-N
Molecular Weight 350.192 g/mol
SMILES OC1(C2C3C4[Fe]23(C4C(C1)(C(C)C)O)(C#[O])(C#[O])C#[O])C(C)C
SPLASH splash10-0002-0090000000-333cddc6a37b16c5b4fa
Source of Spectrum AG-570-265-0
Wiley ID 1341759