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Iron, [1,1'-biphenyl]-2-yldicarbonyl(.eta.5-2,4-cyclopentadien-1-yl)-
SpectraBase Compound ID AfVIvF8M48k
InChI InChI=1S/C12H9.C5H5.2CO.Fe/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;2*1-2;/h1,3-10H;1-5H;;;
InChIKey QVZOYTUHEJQJKS-UHFFFAOYSA-N
Mol Weight 330.16 g/mol
Molecular Formula C19H14FeO2
Exact Mass 330.034316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96Zgqhy3wlk
Name Iron, [1,1'-biphenyl]-2-yldicarbonyl(.eta.5-2,4-cyclopentadien-1-yl)-
CAS Registry Number 100180-37-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14FeO2
InChI InChI=1S/C12H9.C5H5.2CO.Fe/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;2*1-2;/h1,3-10H;1-5H;;;
InChIKey QVZOYTUHEJQJKS-UHFFFAOYSA-N
Molecular Weight 330.164 g/mol
SMILES [C@]12([Fe]345([C@]2([C@@]5([C@@]4([C@]13[H])[H])[H])[H])(C#[O])(C#[O])c1ccc(cc1)-c1ccccc1)[H]
SPLASH splash10-014l-0090000000-120b5ceb9ecc0566a8b7
Source of Spectrum O-21-372-1
Synonyms 1,1'-Biphenyl, iron complex 1,1-bis(hydroxymethyl)-1-(4-phenylphenyl)-1-ferrapentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexane Dicarbonyl-.eta.(5)-cyclopentadienyl-.eta.(1)-(4-phenylphenyl)iron(II)
Wiley ID 1327886