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(Z)-1,2,3,4-Tetra(3,4-dichlorophenyl)-2-butene-1,4-dione
SpectraBase Compound ID JM12D39oH7s
InChI InChI=1S/C28H12Cl8O2/c29-17-5-1-13(9-21(17)33)25(27(37)15-3-7-19(31)23(35)11-15)26(14-2-6-18(30)22(34)10-14)28(38)16-4-8-20(32)24(36)12-16/h1-12H/b26-25-
InChIKey NHXHIQKZLDZDLP-QPLCGJKRSA-N
Mol Weight 664.0 g/mol
Molecular Formula C28H12Cl8O2
Exact Mass 659.834551 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KohwFGGiOg9
Name (Z)-1,2,3,4-Tetra(3,4-dichlorophenyl)-2-butene-1,4-dione
Alternate Name(s) (2Z)-1,2,3,4-tetrakis(3,4-dichlorophenyl)-2-butene-1,4-dione
Comments Removed - expert review - solvent impurities
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Formula C28H12Cl8O2
InChI InChI=1S/C28H12Cl8O2/c29-17-5-1-13(9-21(17)33)25(27(37)15-3-7-19(31)23(35)11-15)26(14-2-6-18(30)22(34)10-14)28(38)16-4-8-20(32)24(36)12-16/h1-12H/b26-25-
InChIKey NHXHIQKZLDZDLP-QPLCGJKRSA-N
Molecular Weight 664.026 g/mol
SMILES c1(\C(=C/(c2cc(Cl)c(cc2)Cl)C(c2cc(Cl)c(cc2)Cl)=O)C(c2cc(Cl)c(cc2)Cl)=O)cc(Cl)c(cc1)Cl
SPLASH splash10-00di-0900002000-6b1d4bff302e27711af2
Source of Spectrum O1-31-1366-2
Wiley ID 818903