Tricarbonyl[(1-4(.elata.)-5-(6-imino-4,5-dimethylcyclohexa-1,4-dien-3-only)-1,3-cyclohexadiene]iron

SpectraBase Compound ID	4qGoQoSnvnN
InChI	InChI=1S/C14H15NO.3CO.Fe/c1-9-10(2)14(15)12(8-13(9)16)11-6-4-3-5-7-11;3*1-2;/h3-6,8,11,15H,7H2,1-2H3;;;;
InChIKey	HHDURTCQKXATDC-UHFFFAOYSA-N Google Search
Mol Weight	353.16 g/mol
Molecular Formula	C17H15FeNO4
Exact Mass	353.035044 g/mol

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SpectraBase Spectrum ID	JNqIsqNFnl2
Name	Tricarbonyl[(1-4(.elata.)-5-(6-imino-4,5-dimethylcyclohexa-1,4-dien-3-only)-1,3-cyclohexadiene]iron
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H15FeNO4
InChI	InChI=1S/C14H15NO.3CO.Fe/c1-9-10(2)14(15)12(8-13(9)16)11-6-4-3-5-7-11;3*1-2;/h3-6,8,11,15H,7H2,1-2H3;;;;
InChIKey	HHDURTCQKXATDC-UHFFFAOYSA-N
Molecular Weight	353.155 g/mol
SMILES	N=C1C(C2C3[Fe]45(C3C5C4C2)(C#[O])(C#[O])C#[O])=CC(=O)C(=C1C)C
SPLASH	splash10-014i-0190000000-c891b7a302afc4105d98
Source of Spectrum	F-49-854-8
Synonyms	1,1,1-tris(hydroxymethyl)-9-imino-10,11-dimethyl-1-ferranonacyclo[6.5.0.0(1,3).0(1,4).0(1,5).0(1,10).0(1,11).0(2,7).0(8,13)]tridecan-12-one
Wiley ID	1343835