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(1RS,2RS,5SR,2E,4E)-Tricarbonyl-{[.eta(4).-(2->5)-1-cyanohexa-2,4-dienyl]-(3',5'-dinitrobenzoate}-iron
SpectraBase Compound ID 1QjD8TtgqMJ
InChI InChI=1S/C14H11N3O6.3CO.Fe/c1-2-3-4-5-13(9-15)23-14(18)10-6-11(16(19)20)8-12(7-10)17(21)22;3*1-2;/h2-8,13H,1H3;;;;/t13-;;;;/m1..../s1
InChIKey JEIAEBIVJHHXEX-SVZPRBGCSA-N
Mol Weight 457.13 g/mol
Molecular Formula C17H11FeN3O9
Exact Mass 456.984465 g/mol
Enantiomer InChIKey JEIAEBIVJHHXEX-AHJYMZSGSA-N
Racemate InChIKey JEIAEBIVJHHXEX-UHFFFAOYSA-N
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