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4-(p-Chlorobenzoyl)-5-methylthio-2-phenyl-2-methylisoimidazole
SpectraBase Compound ID DAsvqiTXmx5
InChI InChI=1S/C18H15ClN2OS/c1-18(13-6-4-3-5-7-13)20-15(17(21-18)23-2)16(22)12-8-10-14(19)11-9-12/h3-11H,1-2H3
InChIKey JJGQDHKEDHBFHV-UHFFFAOYSA-N
Mol Weight 342.84 g/mol
Molecular Formula C18H15ClN2OS
Exact Mass 342.059362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gQ0bitino3
Name 4-(p-Chlorobenzoyl)-5-methylthio-2-phenyl-2-methylisoimidazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClN2OS
InChI InChI=1S/C18H15ClN2OS/c1-18(13-6-4-3-5-7-13)20-15(17(21-18)23-2)16(22)12-8-10-14(19)11-9-12/h3-11H,1-2H3
InChIKey JJGQDHKEDHBFHV-UHFFFAOYSA-N
Molecular Weight 342.844 g/mol
SMILES C1(=NC(c2ccccc2)(C)N=C1SC)C(c1ccc(cc1)Cl)=O
SPLASH splash10-0gy7-0973000000-07e17fc09c1cfc1d5611
Source of Spectrum SO-0-549-3
Synonyms (4-chlorophenyl)-[2-methyl-5-(methylthio)-2-phenyl-4-imidazolyl]methanone (4-chlorophenyl)-(2-methyl-5-methylsulfanyl-2-phenylimidazol-4-yl)methanone (4-chlorophenyl)-(2-methyl-5-methylsulfanyl-2-phenyl-imidazol-4-yl)methanone
Wiley ID 1539412