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4-[anilino(sulfanyl)methylene]-5-methyl-2-(4-methylthiazol-2-yl)pyrazol-3-one
SpectraBase Compound ID 3TDfV61y8Wx
InChI InChI=1S/C15H14N4OS2/c1-9-8-22-15(16-9)19-14(20)12(10(2)18-19)13(21)17-11-6-4-3-5-7-11/h3-8,17,21H,1-2H3
InChIKey SBVDCIMXEKEVHN-UHFFFAOYSA-N
Mol Weight 330.42 g/mol
Molecular Formula C15H14N4OS2
Exact Mass 330.060903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKqkFZIWq14
Name 4-[anilino(sulfanyl)methylene]-5-methyl-2-(4-methylthiazol-2-yl)pyrazol-3-one
Appearance Yellow crystals
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Formula C15H14N4OS2
InChI InChI=1S/C15H14N4OS2/c1-9-8-22-15(16-9)19-14(20)12(10(2)18-19)13(21)17-11-6-4-3-5-7-11/h3-8,17,21H,1-2H3
InChIKey SBVDCIMXEKEVHN-UHFFFAOYSA-N
Instrument Name Shimadzu Qp-2010 Plus
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2588
SMILES SC(=C1C(C)=NN(C1=O)c1scc(n1)C)Nc1ccccc1
SPLASH splash10-052f-8392000000-567348408ecfbccb9d52
Source of Spectrum Y-54-SM26-21a
Thin-Layer Chromatography Rf = 0.32 (petroleum ether/ethyl acetate, 3:1)
Wiley ID 1877838