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Iron, (.eta.-4-1,3-butadiene)(.eta.-4-1,3,6-heptatriene)(triethylphosphine)

View entire compound with spectra: 2 MS (GC)

Iron, (.eta.-4-1,3-butadiene)(.eta.-4-1,3,6-heptatriene)(triethylphosphine)
SpectraBase Compound ID Az2hWsAxqlZ
InChI InChI=1S/C7H10.C6H15P.C4H6.Fe/c1-3-5-7-6-4-2;1-4-7(5-2)6-3;1-3-4-2;/h3-5,7H,1-2,6H2;4-6H2,1-3H3;3-4H,1-2H2;/b7-5+;;;
InChIKey RCZRDCQREGRLBR-OACAQMFHSA-N
Mol Weight 314.19 g/mol
Molecular Formula C17H23FeP
Exact Mass 314.088674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LM7tfmRgC0K
Name Iron, (.eta.-4-1,3-butadiene)(.eta.-4-1,3,6-heptatriene)(triethylphosphine)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H31FeP
InChI InChI=1S/C7H10.C6H15P.C4H6.Fe/c1-3-5-7-6-4-2;1-4-7(5-2)6-3;1-3-4-2;/h3-5,7H,1-2,6H2;4-6H2,1-3H3;3-4H,1-2H2;/b7-5+;;;
InChIKey RCZRDCQREGRLBR-OACAQMFHSA-N
Molecular Weight 314.190 g/mol
SMILES [CH][C][C][C]CC=C.CC[P-](CC)(CC)[Fe+].[CH][C][C][CH]
SPLASH splash10-014i-9550000000-0985487b0e3acfb2434c
Synonyms Iron, (.eta.-4-butadiene)(.eta.-4-hepta-1,3,6-triene)-triethylphosphine Eisen, (hapto-4-1,3-butadien)(hapto-4-1,3,6-heptatrien)(triethylphosphan) Eisen, (hapto-4-butadien)(hapto-4-hepta-1,3,6-trien)-triethylphosphan
Wiley ID 1494620