Tricarbonyl[(1,2,3,4-.eta.-2,2-dimethyl-3-oxo-5-phenylpent-4-en-1-yl)cyclobuta-1,3-diene]iron

SpectraBase Compound ID	4grvowFpBJT
InChI	InChI=1S/C17H18O.3CO.Fe/c1-17(2,13-15-9-6-10-15)16(18)12-11-14-7-4-3-5-8-14;3*1-2;/h3-12H,13H2,1-2H3;;;;/b12-11+;;;;
InChIKey	FWVTXIVLTLLCQN-MOSUJMLHSA-N Google Search
Mol Weight	378.21 g/mol
Molecular Formula	C20H18FeO4
Exact Mass	378.055445 g/mol

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SpectraBase Spectrum ID	BSKMzSs4Eik
Name	Tricarbonyl[(1,2,3,4-.eta.-2,2-dimethyl-3-oxo-5-phenylpent-4-en-1-yl)cyclobuta-1,3-diene]iron
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H18FeO4
InChI	InChI=1S/C17H18O.3CO.Fe/c1-17(2,13-15-9-6-10-15)16(18)12-11-14-7-4-3-5-8-14;3*1-2;/h3-12H,13H2,1-2H3;;;;/b12-11+;;;;
InChIKey	FWVTXIVLTLLCQN-MOSUJMLHSA-N
Molecular Weight	378.205 g/mol
SMILES	[C@]12([Fe]34([C@]2([C@@]4([C@]13[H])[H])[H])(C#[O])(C#[O])C#[O])CC(C(\C=C\c1ccccc1)=O)(C)C
SPLASH	splash10-054o-8590000000-6912bc370e87d22450dc
Source of Spectrum	SO-0-1409-25
Wiley ID	876941