Wiley SpectraBase; SpectraBase Compound ID=1qulNKa5u1 SpectraBase Spectrum ID=3ji7AvHEbjU
http://spectrabase.com/spectrum/3ji7AvHEbjU (accessed Oct 28, 2020).

(ETA-(4)-BUTA-1,3-DIENE)-CARBONYLBIS-(TRIETHYLPHOSPHINE)-IRON;ISOMER-#1/2
SpectraBase Compound ID 1qulNKa5u1
InChI InChI=1S/4C6H15P.2C4H6.2CO.2Fe/c4*1-4-7(5-2)6-3;2*1-3-4-2;2*1-2;;/h4*4-6H2,1-3H3;2*3-4H,1-2H2;;;;/q;;;;;;;;2*-2/p+4
InChIKey NGEMIPZGWDYTBL-UHFFFAOYSA-R
Mol Weight 748.5 g/mol
Molecular Formula C34H72Fe2O2P4
Exact Mass 748.318164 g/mol

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SpectraBase Spectrum ID 3ji7AvHEbjU
SpectraBase Batch ID 2OIdjHagAmo
Name (ETA-(4)-BUTA-1,3-DIENE)-CARBONYLBIS-(TRIETHYLPHOSPHINE)-IRON;ISOMER-#1/2
Compound Number 45
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H72Fe2O2P4
InChI InChI=1S/4C6H15P.2C4H6.2CO.2Fe/c4*1-4-7(5-2)6-3;2*1-3-4-2;2*1-2;;/h4*4-6H2,1-3H3;2*3-4H,1-2H2;;;;/q;;;;;;;;2*-2/p+4
InChIKey NGEMIPZGWDYTBL-UHFFFAOYSA-R
Literature Reference Author C.M.ADAMS,A.HAFNER,M.KOLLER,A.MARCUZZI,R.PREWO,I.SOLANA,B.VI NCENT,W.VONPHILIPSBO
Literature Reference Citation HELV.CHIM.ACTA,72,1658(1989)
Literature Reference DOI 10.1002/hlca.19890720803
Molecular Weight 748.534 g/mol
Solvent ACETONE-D6
Source File Reference UWCS9415
SpectraBase Compound ID 1qulNKa5u1