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4-Methylbenzenesulfonic acid N'-(4-chlorobenzylidene)-N-(3-oxobutyl)hydrazide
SpectraBase Compound ID 2u0fZ3zVsVQ
InChI InChI=1S/C18H19ClN2O3S/c1-14-3-9-18(10-4-14)25(23,24)21(12-11-15(2)22)20-13-16-5-7-17(19)8-6-16/h3-10,13H,11-12H2,1-2H3/b20-13+
InChIKey BIJDRBCEZUJWLG-DEDYPNTBSA-N
Mol Weight 378.87 g/mol
Molecular Formula C18H19ClN2O3S
Exact Mass 378.080491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDOHljuHEIF
Name 4-Methylbenzenesulfonic acid N'-(4-chlorobenzylidene)-N-(3-oxobutyl)hydrazide
Alternate Name(s) N'-[(E)-(4-chlorophenyl)methylidene]-4-methyl-N-(3-oxobutyl)benzenesulfonohydrazide
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Formula C18H19ClN2O3S
InChI InChI=1S/C18H19ClN2O3S/c1-14-3-9-18(10-4-14)25(23,24)21(12-11-15(2)22)20-13-16-5-7-17(19)8-6-16/h3-10,13H,11-12H2,1-2H3/b20-13+
InChIKey BIJDRBCEZUJWLG-DEDYPNTBSA-N
Molecular Weight 378.874 g/mol
SMILES c1(ccc(cc1)C)S(=O)(=O)N(\N=C\c1ccc(cc1)Cl)CCC(C)=O
SPLASH splash10-0f6x-7920000000-58dac94d4d996ef46cf7
Source of Spectrum KC-61-7285-3
Wiley ID 1629943