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2,4-Cyclopentadiene-1-methanol, 1-methyl-, iron complex
SpectraBase Compound ID KYLlMILCyHM
InChI InChI=1S/C7H10O.3CO.Fe/c1-7(6-8)4-2-3-5-7;3*1-2;/h2-5,8H,6H2,1H3;;;;
InChIKey KSLVWUCUUBGOLN-UHFFFAOYSA-N
Mol Weight 250.03 g/mol
Molecular Formula C10H10FeO4
Exact Mass 249.992845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6upbVlkY2sm
Name 2,4-Cyclopentadiene-1-methanol, 1-methyl-, iron complex
Alternate Name(s) Iron, tricarbonyl(1-methyl-2,4-cyclopentadiene-1-methanol)-, stereoisomer Iron, tricarbonyl[(2,3,4,5-.eta.)-1-methyl-2,4-cyclopentadiene-1-methanol]-, stereoisomer (5-endo-methyl-5-exo-(hydroxymethyl)cyclopentadienyl)iron tricarbonyl (5-exo-methyl-5-endo-(hydroxymethyl)cyclopentadienyl)iron tricarbonyl [1,1,1-tris(hydroxymethyl)-5-methyl-1-ferratetracyclo[2.2.0.0(1,3).0(2,6)]hexan-5-yl]methanol
CAS Registry Number 34823-27-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10FeO4
InChI InChI=1S/C7H10O.3CO.Fe/c1-7(6-8)4-2-3-5-7;3*1-2;/h2-5,8H,6H2,1H3;;;;
InChIKey KSLVWUCUUBGOLN-UHFFFAOYSA-N
Molecular Weight 250.031 g/mol
SMILES OC[C@]1([C@@]2([Fe]34([C@@]2([C@]4([C@@]13[H])[H])[H])(C#[O])(C#[O])C#[O])[H])C
SPLASH splash10-05oy-7900000000-74bee7492e2c0e0a3f9a
Source of Spectrum AG-55-169-21
Wiley ID 1252668