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N-{Tricarbonyl[ .eta(4).-cyclobutadien-1'-yl]ferrio}-N-propylamine
SpectraBase Compound ID 4PFwfkPpc8y
InChI InChI=1S/C7H11N.3CO.Fe/c1-2-6-8-7-4-3-5-7;3*1-2;/h3-5,8H,2,6H2,1H3;;;;
InChIKey ZHVCFHFGQBRMMH-UHFFFAOYSA-N
Mol Weight 249.05 g/mol
Molecular Formula C10H11FeNO3
Exact Mass 249.008829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fJ6koXsgj9
Name N-{Tricarbonyl[ .eta(4).-cyclobutadien-1'-yl]ferrio}-N-propylamine
Alternate Name(s) 1,1,1-tris(hydroxymethyl)-N-propyl-1-ferratetracyclo[2.1.0.0(1,3).0(2,5)]pentan-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11FeNO3
InChI InChI=1S/C7H11N.3CO.Fe/c1-2-6-8-7-4-3-5-7;3*1-2;/h3-5,8H,2,6H2,1H3;;;;
InChIKey ZHVCFHFGQBRMMH-UHFFFAOYSA-N
Molecular Weight 249.047 g/mol
SMILES N([C@]12[Fe]34([C@@]2([C@]4([C@@]13[H])[H])[H])(C#[O])(C#[O])C#[O])CCC
SPLASH splash10-00xr-0980000000-f7e0f3c8e657cba510ab
Source of Spectrum K-128-1057-2
Wiley ID 1251936