(+-)-tricarbonyl{1,2,3,4.eta.-[3-methyl-endo-6-(1-methylethyl)-1,2-cyclohexadien-5-ol]}iron

SpectraBase Compound ID	E6BzRP0J4AE
InChI	InChI=1S/C10H16O.3CO.Fe/c1-7(2)9-5-4-8(3)6-10(9)11;3*1-2;/h4-7,9-11H,1-3H3;;;;
InChIKey	JOVWUJJTWDMJLA-UHFFFAOYSA-N Google Search
Mol Weight	292.11 g/mol
Molecular Formula	C13H16FeO4
Exact Mass	292.039795 g/mol

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SpectraBase Spectrum ID	K1FRBuzdTht
Name	(+-)-tricarbonyl{1,2,3,4.eta.-[3-methyl-endo-6-(1-methylethyl)-1,2-cyclohexadien-5-ol]}iron
Alternate Name(s)	1,1,1-tris(hydroxymethyl)-7-methyl-4-(propan-2-yl)-1-ferratetracyclo[3.2.0.0(1,6).0(2,7)]heptan-3-ol
CAS Registry Number	124855-96-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H16FeO4
InChI	InChI=1S/C10H16O.3CO.Fe/c1-7(2)9-5-4-8(3)6-10(9)11;3*1-2;/h4-7,9-11H,1-3H3;;;;
InChIKey	JOVWUJJTWDMJLA-UHFFFAOYSA-N
Molecular Weight	292.112 g/mol
SMILES	OC1[C@@]2([Fe]34([C@]2(C)[C@]4([C@]3(C1C(C)C)[H])[H])(C#[O])(C#[O])C#[O])[H]
SPLASH	splash10-00dl-4920000000-9cc576ae5c51de0505ab
Source of Spectrum	K-123-1085-13
Wiley ID	1295055