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1-(p-Chlorophenacyl)-2,4-dinitroimidazole
SpectraBase Compound ID E4MXJuRXLFb
InChI InChI=1S/C11H7ClN4O5/c12-8-3-1-7(2-4-8)9(17)5-14-6-10(15(18)19)13-11(14)16(20)21/h1-4,6H,5H2
InChIKey RPFDMYPHOKDYIX-UHFFFAOYSA-N
Mol Weight 310.65 g/mol
Molecular Formula C11H7ClN4O5
Exact Mass 310.010497 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19j89BsendT
Name 1-(p-Chlorophenacyl)-2,4-dinitroimidazole
Alternate Name(s) 1-(4-chlorophenyl)-2-(2,4-dinitro-1-imidazolyl)ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C11H7ClN4O5
InChI InChI=1S/C11H7ClN4O5/c12-8-3-1-7(2-4-8)9(17)5-14-6-10(15(18)19)13-11(14)16(20)21/h1-4,6H,5H2
InChIKey RPFDMYPHOKDYIX-UHFFFAOYSA-N
Molecular Weight 310.653 g/mol
SMILES c1(nc([n](c1)CC(c1ccc(cc1)Cl)=O)N(=O)=O)N(=O)=O
SPLASH splash10-000i-0904000000-0f717ec2d9f8386f6d0c
Source of Spectrum Y-47-1053-20
Wiley ID 1667389