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Iron, tricarbonyl[(1,2-.eta.)-2,3-dimethyl-1,3-butadiene][(2,3-.eta.)-methyl 2-propenoate]-
SpectraBase Compound ID 4yxKqmKfrmu
InChI InChI=1S/C6H10.C4H6O2.3CO.Fe/c1-5(2)6(3)4;1-3-4(5)6-2;3*1-2;/h1,3H2,2,4H3;3H,1H2,2H3;;;;
InChIKey RXLWXWXXJRMJBA-UHFFFAOYSA-N
Mol Weight 305.09 g/mol
Molecular Formula C13H13FeO5
Exact Mass 305.011235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZCfI2clr09
Name Iron, tricarbonyl[(1,2-.eta.)-2,3-dimethyl-1,3-butadiene][(2,3-.eta.)-methyl 2-propenoate]-
Alternate Name(s) 2,3-Dimethylbut-3-ene-1,2-diide 3-methoxy-3-oxopropane-1,2-diide tris(methanidylidyneoxidanium) iron Iron, tricarbonyl[(1,2-eta)-2,3-dimethyl-1,3-butadiene][(2,3-eta)-methyl 2-propenoate]-
CAS Registry Number 62265-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16FeO5
InChI InChI=1S/C6H10.C4H6O2.3CO.Fe/c1-5(2)6(3)4;1-3-4(5)6-2;3*1-2;/h1,3H2,2,4H3;3H,1H2,2H3;;;;
InChIKey RXLWXWXXJRMJBA-UHFFFAOYSA-N
Molecular Weight 305.087 g/mol
SMILES [Fe].[O+]#[C-].[O+]#[C-].[O+]#[C-].C(=C)([C](C)[CH])C.C(=O)(OC)[C][CH]
SPLASH splash10-004i-9310000000-60592fbd0f5dafe5182a
Source of Spectrum W5-27702-0-0
Wiley ID 1309406