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Iron, tricarbonyl-(tetraphenylcyclopentadienon)
SpectraBase Compound ID GPqvrvWzaqF
InChI InChI=1S/C29H20O.3CO.Fe/c30-29-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(29)24-19-11-4-12-20-24;3*1-2;/h1-20H;;;;
InChIKey VDQCQYPXUXUDOU-UHFFFAOYSA-N
Mol Weight 524.353 g/mol
Molecular Formula C32H20FeO4
Exact Mass 524.071095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcMNIZ3u6He
Name Iron, tricarbonyl-(tetraphenylcyclopentadienon)
CAS Registry Number 33504-08-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H20FeO4
InChI InChI=1S/C29H20O.3CO.Fe/c30-29-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(29)24-19-11-4-12-20-24;3*1-2;/h1-20H;;;;
InChIKey VDQCQYPXUXUDOU-UHFFFAOYSA-N
Molecular Weight 524.353 g/mol
SMILES [Fe].c1cc([C]2C([C]([C](c3ccccc3)[C]2c2ccccc2)c2ccccc2)=O)ccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+]
SPLASH splash10-0006-2331900000-a54899ab5a7a7aaebf38
Source of Spectrum HE-1982-0-0
Synonyms Iron, tricarbonyl[(2,3,4,5-.eta.)-2,3,4,5-tetraphenyl-2,4-cyclopentadien-1-one]-
Wiley ID 1402607