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Dicarbonyl[eta5-(diphenylmethyl)cyclopentadienyl](methoxycarbonyl)iron

View entire compound with spectra: 1 MS (GC)

Dicarbonyl[eta5-(diphenylmethyl)cyclopentadienyl](methoxycarbonyl)iron
SpectraBase Compound ID 4YTExv3H8AI
InChI InChI=1S/C18H15.C2H3O2.2CO.Fe/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;1-4-2-3;2*1-2;/h1-14,18H;1H3;;;/q2*-1;;;+2
InChIKey SBIUIWVVVCVBMG-UHFFFAOYSA-N
Mol Weight 402.227 g/mol
Molecular Formula C22H18FeO4
Exact Mass 402.055445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FA3fIIjiFL0
Name Dicarbonyl[eta5-(diphenylmethyl)cyclopentadienyl](methoxycarbonyl)iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18FeO4
InChI InChI=1S/C18H15.C2H3O2.2CO.Fe/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;1-4-2-3;2*1-2;/h1-14,18H;1H3;;;/q2*-1;;;+2
InChIKey SBIUIWVVVCVBMG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19811140435
Molecular Weight 402.227 g/mol
SMILES [C-](OC)=O.c1cc([cH-]c1)C(c1ccccc1)c1ccccc1.[Fe+2].[C-]#[O+].[C-]#[O+]
SPLASH splash10-0fui-0191000000-bf70c2efa4e4b7874c6b
Source of Spectrum K-114-1560-7a
Wiley ID 1792860