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4-(1H-Benzimidazol-2-ylsulfanyl)-5-nitrophthalonitrile
SpectraBase Compound ID L7w0B7h3WDp
InChI InChI=1S/C15H7N5O2S/c16-7-9-5-13(20(21)22)14(6-10(9)8-17)23-15-18-11-3-1-2-4-12(11)19-15/h1-6H,(H,18,19)
InChIKey LRTGGNZQUXYRJW-UHFFFAOYSA-N
Mol Weight 321.31 g/mol
Molecular Formula C15H7N5O2S
Exact Mass 321.032046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CDkNqm40VX
Name 4-(1H-Benzimidazol-2-ylsulfanyl)-5-nitrophthalonitrile
Alternate Name(s) 4-(1H-benzimidazol-2-ylthio)-5-nitro-phthalonitrile 4-(1H-benzimidazol-2-ylthio)-5-nitrobenzene-1,2-dicarbonitrile 4-(1H-benzimidazol-2-ylsulfanyl)-5-nitro-benzene-1,2-dicarbonitrile 4-(1H-benzimidazol-2-ylsulfanyl)-5-nitro-phthalonitrile 4-(1H-benzimidazol-2-ylsulfanyl)-5-nitrobenzene-1,2-dicarbonitrile Benzene-1,2-dicarbonitrile, 4-(2-benzimidazolylthio)-5-nitro-
CAS Registry Number 309735-69-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H7N5O2S
InChI InChI=1S/C15H7N5O2S/c16-7-9-5-13(20(21)22)14(6-10(9)8-17)23-15-18-11-3-1-2-4-12(11)19-15/h1-6H,(H,18,19)
InChIKey LRTGGNZQUXYRJW-UHFFFAOYSA-N
Molecular Weight 321.314 g/mol
SMILES [nH]1c2ccccc2nc1Sc1c(N(=O)=O)cc(c(c1)C#N)C#N
SPLASH splash10-00fr-4592000000-067b5ae36686aacddec9
Source of Spectrum IY-3-98-0
Wiley ID 1718046