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Tricarbonyl-[7-( Cyclohepta-2',4',6'-trien-1'-yl)cyclohepta-2,4-diene-1,6-dione]-iron
SpectraBase Compound ID J9UF8P9k6IO
InChI InChI=1S/C14H12O2.3CO.Fe/c15-12-9-5-6-10-13(16)14(12)11-7-3-1-2-4-8-11;3*1-2;/h1-11,14H;;;;/q;3*+1;
InChIKey WCAJIEZVRJSMAU-UHFFFAOYSA-N
Mol Weight 352.12 g/mol
Molecular Formula C17H12FeO5
Exact Mass 352.003409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DT1j3O0B3Ek
Name Tricarbonyl-[7-( Cyclohepta-2',4',6'-trien-1'-yl)cyclohepta-2,4-diene-1,6-dione]-iron
Alternate Name(s) Bis[N-(4,5-diethyl-1,2,3-trimethyl-2,3-dihydro-1,3-diborole)rhodiumchlorid]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12FeO5
InChI InChI=1S/C14H12O2.3CO.Fe/c15-12-9-5-6-10-13(16)14(12)11-7-3-1-2-4-8-11;3*1-2;/h1-11,14H;;;;/q;3*+1;
InChIKey WCAJIEZVRJSMAU-UHFFFAOYSA-N
Molecular Weight 352.123 g/mol
SMILES C12[Fe]34(C2C(=O)C(C(C4C13)=O)C1C=CC=CC=C1)(C#[O+])(C#[O+])C#[O+]
SPLASH splash10-00xr-0069000000-914fa4eeb503538ba6c1
Source of Spectrum AG-570-265-0
Wiley ID 1343039