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1-Ethanone, 1-[4-(1H-1,3-benzimidazol-2-ylthio)-3-nitrophenyl]-
SpectraBase Compound ID 69gdJOFw1Yt
InChI InChI=1S/C15H11N3O3S/c1-9(19)10-6-7-14(13(8-10)18(20)21)22-15-16-11-4-2-3-5-12(11)17-15/h2-8H,1H3,(H,16,17)
InChIKey SLPIJEOCCRQURC-UHFFFAOYSA-N
Mol Weight 313.33 g/mol
Molecular Formula C15H11N3O3S
Exact Mass 313.052112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Ms4emqbVeF
Name 1-Ethanone, 1-[4-(1H-1,3-benzimidazol-2-ylthio)-3-nitrophenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11N3O3S
InChI InChI=1S/C15H11N3O3S/c1-9(19)10-6-7-14(13(8-10)18(20)21)22-15-16-11-4-2-3-5-12(11)17-15/h2-8H,1H3,(H,16,17)
InChIKey SLPIJEOCCRQURC-UHFFFAOYSA-N
Molecular Weight 313.331 g/mol
SMILES [nH]1c(nc2ccccc12)Sc1c(cc(cc1)C(C)=O)N(=O)=O
SPLASH splash10-00kf-9561000000-64a8307f6cb53399cae7
Source of Spectrum IY-1-4445-8
Synonyms 1-[4-(1H-benzimidazol-2-ylthio)-3-nitrophenyl]ethanone 1-[4-(1H-benzimidazol-2-ylsulfanyl)-3-nitrophenyl]ethanone 1-[4-(1H-benzimidazol-2-ylsulfanyl)-3-nitro-phenyl]ethanone
Wiley ID 1652441