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Iron, tricarbonyl(.eta.2-ethene)(triphenylphosphine)-, stereoisomer
SpectraBase Compound ID B2OyxHNpDOt
InChI InChI=1S/C18H15P.C2H4.3CO.Fe/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;4*1-2;/h1-15H;1-2H2;;;;/q;;;;;+1
InChIKey WTBFBTXCYKYRAG-UHFFFAOYSA-N
Mol Weight 430.22 g/mol
Molecular Formula C23H19FeO3P
Exact Mass 430.042117 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15L9iT01o2n
Name Iron, tricarbonyl(.eta.2-ethene)(triphenylphosphine)-, stereoisomer
Alternate Name(s) Fac-tricarbonyl(.eta.-Ethen)(triphenylphosphan)eisen Triphenyl[1,1,1-tris(hydroxymethyl)-1-ferracyclopropan-1-yl]phosphanium
CAS Registry Number 84521-08-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19FeO3P
InChI InChI=1S/C18H15P.C2H4.3CO.Fe/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;4*1-2;/h1-15H;1-2H2;;;;/q;;;;;+1
InChIKey WTBFBTXCYKYRAG-UHFFFAOYSA-N
Molecular Weight 430.221 g/mol
SMILES c1([P+]([Fe]2(CC2)(C#[O])(C#[O])C#[O])(c2ccccc2)c2ccccc2)ccccc1
SPLASH splash10-014i-0039000000-1af46664a18315e7e6f6
Source of Spectrum K-118-3926-5
Wiley ID 1381486