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Iron, tricarbonyl-1,4,5,6-.eta.-E4-hept-4-ene-1,6-diyl-(exo)-carboxylic acid, methyl ester
SpectraBase Compound ID 98o12WYlCdK
InChI InChI=1S/C9H14O2.3CO.Fe/c1-3-4-5-6-7-8-9(10)11-2;3*1-2;/h3-5,8H,6-7H2,1-2H3;;;;
InChIKey KUKCLLBZBNGXKD-UHFFFAOYSA-N
Mol Weight 291.06 g/mol
Molecular Formula C12H11FeO5
Exact Mass 290.995584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hoB7BZukw7
Name Iron, tricarbonyl-1,4,5,6-.eta.-E4-hept-4-ene-1,6-diyl-(exo)-carboxylic acid, methyl ester
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Formula C12H14FeO5
InChI InChI=1S/C9H14O2.3CO.Fe/c1-3-4-5-6-7-8-9(10)11-2;3*1-2;/h3-5,8H,6-7H2,1-2H3;;;;
InChIKey KUKCLLBZBNGXKD-UHFFFAOYSA-N
Molecular Weight 291.060 g/mol
SMILES C[C][C][C]CCC([Fe])C(=O)OC.[O+]#[C-].[O+]#[C-].[O+]#[C-]
SPLASH splash10-08ir-9420000000-86cdaa462400e116a62e
Synonyms Iron, tricarbonyl-1,4,5,6-.eta.-E4-hept-4-ene-1,6-diyl-(endo)-carboxylic acid, methyl ester
Wiley ID 1504454