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1,1'-(1,5-Pentamethylene)-2,2'-bis(trichloroacetyl)-4,4'-dinitrobis(imidazole)
SpectraBase Compound ID HefyOcBNu9e
InChI InChI=1S/C15H12Cl6N6O6/c16-14(17,18)10(28)12-22-8(26(30)31)6-24(12)4-2-1-3-5-25-7-9(27(32)33)23-13(25)11(29)15(19,20)21/h6-7H,1-5H2
InChIKey GJUUNKFJSMXUOS-UHFFFAOYSA-N
Mol Weight 585.0 g/mol
Molecular Formula C15H12Cl6N6O6
Exact Mass 581.894948 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGV06ABZ8qT
Name 1,1'-(1,5-Pentamethylene)-2,2'-bis(trichloroacetyl)-4,4'-dinitrobis(imidazole)
Comments Less than 3 mono-isotopic peaks
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Formula C15H12Cl6N6O6
InChI InChI=1S/C15H12Cl6N6O6/c16-14(17,18)10(28)12-22-8(26(30)31)6-24(12)4-2-1-3-5-25-7-9(27(32)33)23-13(25)11(29)15(19,20)21/h6-7H,1-5H2
InChIKey GJUUNKFJSMXUOS-UHFFFAOYSA-N
Molecular Weight 585.015 g/mol
SMILES c1(nc(C(C(Cl)(Cl)Cl)=O)[n](c1)CCCCC[n]1c(nc(c1)N(=O)=O)C(C(Cl)(Cl)Cl)=O)N(=O)=O
SPLASH splash10-0a4i-9000100000-731bfe73ad59d215c2a3
Source of Spectrum J-65-1106-12
Synonyms 2,2,2-trichloro-1-[4-nitro-1-[5-[4-nitro-2-(2,2,2-trichloro-1-oxoethyl)-1-imidazolyl]pentyl]-2-imidazolyl]ethanone 2,2,2-tris(chloranyl)-1-[4-nitro-1-[5-[4-nitro-2-[2,2,2-tris(chloranyl)ethanoyl]imidazol-1-yl]pentyl]imidazol-2-yl]ethanone
Wiley ID 1532121