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1,4-Bis(5-formyl-5':2,2'-bithienyl)-1,4-butanedione
SpectraBase Compound ID 28oRptD0n6e
InChI InChI=1S/C22H14O4S4/c23-11-13-1-5-19(27-13)21-9-7-17(29-21)15(25)3-4-16(26)18-8-10-22(30-18)20-6-2-14(12-24)28-20/h1-2,5-12H,3-4H2
InChIKey OIAHOBSJLBHOLP-UHFFFAOYSA-N
Mol Weight 470.6 g/mol
Molecular Formula C22H14O4S4
Exact Mass 469.977494 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GncKoe6HSLR
Name 1,4-Bis(5-formyl-5':2,2'-bithienyl)-1,4-butanedione
Alternate Name(s) 5-[5-[4-[5-(5-formyl-2-thiophenyl)-2-thiophenyl]-1,4-dioxobutyl]-2-thiophenyl]-2-thiophenecarboxaldehyde 5-[5-[4-[5-(5-formylthiophen-2-yl)thiophen-2-yl]-4-oxobutanoyl]thiophen-2-yl]thiophene-2-carbaldehyde 5-[5-[4-[5-(5-formyl-2-thienyl)-2-thienyl]-4-oxo-butanoyl]-2-thienyl]thiophene-2-carbaldehyde 5-[5-[4-[5-(5-methanoylthiophen-2-yl)thiophen-2-yl]-4-oxidanylidene-butanoyl]thiophen-2-yl]thiophene-2-carbaldehyde
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Formula C22H14O4S4
InChI InChI=1S/C22H14O4S4/c23-11-13-1-5-19(27-13)21-9-7-17(29-21)15(25)3-4-16(26)18-8-10-22(30-18)20-6-2-14(12-24)28-20/h1-2,5-12H,3-4H2
InChIKey OIAHOBSJLBHOLP-UHFFFAOYSA-N
Molecular Weight 470.590 g/mol
SMILES c1(sc(cc1)C(CCC(c1sc(-c2sc(C=O)cc2)cc1)=O)=O)-c1sc(C=O)cc1
SPLASH splash10-00di-0590000000-4b8f9fb6c06ad805abc4
Source of Spectrum QA-39-329-14
Wiley ID 861521