(3E)-Tricarbonyl {.eta.-[methyl (2'-methoxycarbonyl-5'-methyl)-3,5-hexadienoate]iron (0)

SpectraBase Compound ID	Hc1emyOQGJB
InChI	InChI=1S/C10H14O4.3CO.Fe/c1-7(2)5-6-8(9(11)13-3)10(12)14-4;3*1-2;/h5-6,8H,1H2,2-4H3;;;;
InChIKey	ZVJHFEYCJDOKAH-UHFFFAOYSA-N Google Search
Mol Weight	338.09 g/mol
Molecular Formula	C13H14FeO7
Exact Mass	338.008889 g/mol

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SpectraBase Spectrum ID	Ac7Cy7ihoxn
Name	(3E)-Tricarbonyl {.eta.-[methyl (2'-methoxycarbonyl-5'-methyl)-3,5-hexadienoate]iron (0)
Alternate Name(s)	1,3-Dimethyl 2-[1,1,1-tris(hydroxymethyl)-4-methyl-1-ferratricyclo[2.1.0.0(1,3)]pentan-2-yl]propanedioate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H14FeO7
InChI	InChI=1S/C10H14O4.3CO.Fe/c1-7(2)5-6-8(9(11)13-3)10(12)14-4;3*1-2;/h5-6,8H,1H2,2-4H3;;;;
InChIKey	ZVJHFEYCJDOKAH-UHFFFAOYSA-N
Molecular Weight	338.093 g/mol
SMILES	[C@]12([Fe]3(C2)([C@]1(C3C(C(=O)OC)C(=O)OC)[H])(C#[O])(C#[O])C#[O])C
SPLASH	splash10-0uea-1690000000-03d85096bd47b4432fed
Source of Spectrum	K-129-431-6
Wiley ID	1333398