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5-(4-CHLOROPHENYL)-4-CYANO-(3H)-1,2-DITHIOL-3-(ALPHA-DIETHYLPHOSPHORYLMETHYLENE)-THIOMETHYL
SpectraBase Compound ID JZErIlbKCl2
InChI InChI=1S/C16H17ClNO3PS3/c1-4-20-22(19,21-5-2)16(23-3)15-13(10-18)14(24-25-15)11-6-8-12(17)9-7-11/h6-9H,4-5H2,1-3H3/b16-15+
InChIKey FVYJCAVLAYRMPQ-FOCLMDBBSA-N
Mol Weight 433.92 g/mol
Molecular Formula C16H17ClNO3PS3
Exact Mass 432.979672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uPVv77Evdd
Name 5-(p-Chlorophenyl)-3-[(.alpha.-diethylphosphoryl)methylenethiomethyl]-4-cyano-1,2-thiol
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Formula C16H17ClNO3PS3
InChI InChI=1S/C16H17ClNO3PS3/c1-4-20-22(19,21-5-2)16(23-3)15-13(10-18)14(24-25-15)11-6-8-12(17)9-7-11/h6-9H,4-5H2,1-3H3/b16-15+
InChIKey FVYJCAVLAYRMPQ-FOCLMDBBSA-N
Molecular Weight 433.923 g/mol
SMILES C=1(\C(SSC1c1ccc(cc1)Cl)=C\(P(=O)(OCC)OCC)SC)C#N
SPLASH splash10-0a4j-0609700000-cb38cf293b6502b50bdd
Source of Spectrum AJ-42-108-25
Synonyms (5E)-3-(4-chlorophenyl)-5-[diethoxyphosphoryl-(methylthio)methylidene]-4-dithiolecarbonitrile (5E)-3-(4-chlorophenyl)-5-[diethoxyphosphoryl(methylsulfanyl)methylidene]dithiole-4-carbonitrile (5E)-3-(4-chlorophenyl)-5-[diethoxyphosphoryl(methylsulfanyl)methylene]dithiole-4-carbonitrile (5E)-3-(4-chlorophenyl)-5-[diethoxyphosphoryl(methylsulfanyl)methylidene]-1,2-dithiole-4-carbonitrile
Wiley ID 1567761