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N-{(2R)-(2E)-Tricarbonyl[2-5.eta.2,4-pentadienylidebe]iron}benzylamine
SpectraBase Compound ID DzAzcxik3Ap
InChI InChI=1S/C12H13N.3CO.Fe/c1-2-3-7-10-13-11-12-8-5-4-6-9-12;3*1-2;/h2-10H,1,11H2;;;;/b13-10+;;;;
InChIKey HRAPAKGNQCZXRE-HSDORCTDSA-N
Mol Weight 311.12 g/mol
Molecular Formula C15H13FeNO3
Exact Mass 311.024479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QbAWdhvZew
Name N-{(2R)-(2E)-Tricarbonyl[2-5.eta.2,4-pentadienylidebe]iron}benzylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13FeNO3
InChI InChI=1S/C12H13N.3CO.Fe/c1-2-3-7-10-13-11-12-8-5-4-6-9-12;3*1-2;/h2-10H,1,11H2;;;;/b13-10+;;;;
InChIKey HRAPAKGNQCZXRE-HSDORCTDSA-N
Molecular Weight 311.118 g/mol
SMILES C12[Fe]3([C@]2(\C=N\Cc2ccccc2)[H])(C1C3)(C#[O])(C#[O])C#[O]
SPLASH splash10-056r-0090000000-8e3e25e375e3da3b3a59
Source of Spectrum E1-44-953-1
Wiley ID 1553428