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1-N,4-N-bis(1-(2,2-dimethyl-but-3-en-1-ol)-1'-methylideneferrocene)benzene-1,4-diamine
SpectraBase Compound ID 1sSBrExwQcf
InChI InChI=1S/C18H14N2.2C11H15O.2Fe/c1-2-6-15(5-1)13-19-17-9-11-18(12-10-17)20-14-16-7-3-4-8-16;2*1-4-11(2,3)10(12)9-7-5-6-8-9;;/h1-14H;2*4-8,10,12H,1H2,2-3H3;;
InChIKey HVHCBAKQKKAQJU-UHFFFAOYSA-N
Mol Weight 696.5 g/mol
Molecular Formula C40H44Fe2N2O2
Exact Mass 696.210151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9reZZAhjWpW
Name 1-N,4-N-bis(1-(2,2-dimethyl-but-3-en-1-ol)-1'-methylideneferrocene)benzene-1,4-diamine
Alternate Name(s) 1,4-Bis(1-(2,2-dimethyl-but-3-en-1-ol)-1'-formylferrocene)hydrazono-benzene 1-{4'-[N-(4-{[4'-(1-hydroxy-2,2-dimethylbut-3-en-1-yl)-1-ferra-1,1'-spirobi[pentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexane]-4-ylmethylidene]amino}phenyl)carboximidoyl]-1-ferra-1,1'-spirobi[pentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexane]-4- yl}-2,2-dimethylbut-3-en-1-ol
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Formula C40H44Fe2N2O2
InChI InChI=1S/C18H14N2.2C11H15O.2Fe/c1-2-6-15(5-1)13-19-17-9-11-18(12-10-17)20-14-16-7-3-4-8-16;2*1-4-11(2,3)10(12)9-7-5-6-8-9;;/h1-14H;2*4-8,10,12H,1H2,2-3H3;;
InChIKey HVHCBAKQKKAQJU-UHFFFAOYSA-N
Molecular Weight 696.494 g/mol
SMILES OC(C12C3[Fe]2245678(C9C5C6C7C89C=Nc5ccc(N=CC67C8[Fe]779%10%11%12%13(C%14(C(C(C)(C=C)C)O)C%10C%13C%11C%12%14)C8C9C67)cc5)C3C4C12)C(C)(C)C=C
SPLASH splash10-067i-9321110000-b5441f91aa9777c7b855
Source of Spectrum Y0-42A-2419-9
Wiley ID 1743858