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Iron, dicarbonyl(.eta.5-2,4-cyclopentadien-1-yl)(1-oxo-3-phenyl-2-propenyl)-
SpectraBase Compound ID Kk95SAjJ60V
InChI InChI=1S/C9H7O.C5H5.2CO.Fe/c10-8-4-7-9-5-2-1-3-6-9;1-2-4-5-3-1;2*1-2;/h1-7H;1-5H;;;/b7-4+;;;;
InChIKey SAEANJKJGHBZBL-UKTVGUFOSA-N
Mol Weight 308.11 g/mol
Molecular Formula C16H12FeO3
Exact Mass 308.01358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VIEJYp0u2p
Name Iron, dicarbonyl(.eta.5-2,4-cyclopentadien-1-yl)(1-oxo-3-phenyl-2-propenyl)-
CAS Registry Number 12216-33-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12FeO3
InChI InChI=1S/C9H7O.C5H5.2CO.Fe/c10-8-4-7-9-5-2-1-3-6-9;1-2-4-5-3-1;2*1-2;/h1-7H;1-5H;;;/b7-4+;;;;
InChIKey SAEANJKJGHBZBL-UKTVGUFOSA-N
Molecular Weight 308.114 g/mol
SMILES [C@]12([Fe]345([C@]2([C@@]5([C@@]4([C@]13[H])[H])[H])[H])(C#[O])(C#[O])C(\C=C\c1ccccc1)=O)[H]
SPLASH splash10-00xr-4940000000-80893fc68ccc182514cf
Source of Spectrum AD-0-2764-0
Synonyms (2E)-1-[1,1-bis(hydroxymethyl)-1-ferrapentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexan-1-yl]-3-phenylprop-2-en-1-one .pi.-cyclopentadienyl-3-phenylacryloyl-dicarbonyl iron Dicarbonylcinnamoylcyclopentadienyliron
Wiley ID 45835