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2-(2,4-Dinitro-phenylsulfanyl)-1-propyl-1H-benzoimidazole
SpectraBase Compound ID xvnCyyWvBm
InChI InChI=1S/C16H14N4O4S/c1-2-9-18-13-6-4-3-5-12(13)17-16(18)25-15-8-7-11(19(21)22)10-14(15)20(23)24/h3-8,10H,2,9H2,1H3
InChIKey JHYHCAJBMDNIDM-UHFFFAOYSA-N
Mol Weight 358.37 g/mol
Molecular Formula C16H14N4O4S
Exact Mass 358.073576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIUPfvFrspO
Name 2-(2,4-Dinitro-phenylsulfanyl)-1-propyl-1H-benzoimidazole
Alternate Name(s) 2-(2,4-dinitrophenyl)sulfanyl-1-propyl-benzimidazole 2-[(2,4-Dinitrophenyl)sulfanyl]-1-propyl-1H-benzimidazole 2-[(2,4-dinitrophenyl)thio]-1-propyl-benzimidazole 2-[(2,4-dinitrophenyl)thio]-1-propylbenzimidazole
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Formula C16H14N4O4S
InChI InChI=1S/C16H14N4O4S/c1-2-9-18-13-6-4-3-5-12(13)17-16(18)25-15-8-7-11(19(21)22)10-14(15)20(23)24/h3-8,10H,2,9H2,1H3
InChIKey JHYHCAJBMDNIDM-UHFFFAOYSA-N
Molecular Weight 358.372 g/mol
SMILES c1(nc2ccccc2[n]1CCC)Sc1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-02kc-6932000000-e162bad45680d1091e89
Wiley ID 1454428