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4-(4-chlorophenyl)-1-methyl-6-(methylthio)-2-phenyl-3-indazolone
SpectraBase Compound ID 6tUSmsOiWlI
InChI InChI=1S/C21H17ClN2OS/c1-23-19-13-17(26-2)12-18(14-8-10-15(22)11-9-14)20(19)21(25)24(23)16-6-4-3-5-7-16/h3-13H,1-2H3
InChIKey MWKMZHSHEWMLJC-UHFFFAOYSA-N
Mol Weight 380.89 g/mol
Molecular Formula C21H17ClN2OS
Exact Mass 380.075012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NgWaoUCN09
Name 4-(4-chlorophenyl)-1-methyl-6-(methylthio)-2-phenyl-3-indazolone
Comments Less than 3 mono-isotopic peaks
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Formula C21H17ClN2OS
InChI InChI=1S/C21H17ClN2OS/c1-23-19-13-17(26-2)12-18(14-8-10-15(22)11-9-14)20(19)21(25)24(23)16-6-4-3-5-7-16/h3-13H,1-2H3
InChIKey MWKMZHSHEWMLJC-UHFFFAOYSA-N
Molecular Weight 380.893 g/mol
SMILES c12C(N(c3ccccc3)N(c1cc(cc2-c1ccc(cc1)Cl)SC)C)=O
SPLASH splash10-00lr-0009000000-668ec6ea323ff489e9aa
Source of Spectrum F-51-10948-10
Synonyms 4-(4-chlorophenyl)-1-methyl-6-(methylthio)-2-phenyl-indazolin-3-one 4-(4-chlorophenyl)-1-methyl-6-methylsulfanyl-2-phenyl-indazol-3-one
Wiley ID 793625