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1,1,2,4-Tetrachloro-4-(3,5-dimethylphenylthio)-1,3-butadiene
SpectraBase Compound ID hnpB0tutT6
InChI InChI=1S/C12H10Cl4S/c1-7-3-8(2)5-9(4-7)17-11(14)6-10(13)12(15)16/h3-6H,1-2H3/b11-6+
InChIKey IFFMBFVVWSMOMH-IZZDOVSWSA-N
Mol Weight 328.1 g/mol
Molecular Formula C12H10Cl4S
Exact Mass 325.925732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MVASJecp4X
Name 1,1,2,4-Tetrachloro-4-(3,5-dimethylphenylthio)-1,3-butadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Cl4S
InChI InChI=1S/C12H10Cl4S/c1-7-3-8(2)5-9(4-7)17-11(14)6-10(13)12(15)16/h3-6H,1-2H3/b11-6+
InChIKey IFFMBFVVWSMOMH-IZZDOVSWSA-N
Literature Reference DOI 10.5012/bkcs.2010.31.8.2255
Molecular Weight 328.084 g/mol
SMILES C(Cl)(=C(Cl)\C=C\(Sc1cc(cc(c1)C)C)Cl)Cl
SPLASH splash10-0a6r-2191000000-cf81bdba79f9259330fe
Source of Spectrum QB-31-3-4b
Synonyms (Z)-(3,5-dimethylphenyl)(1,3,4,4-tetrachlorobuta-1,3-dien-1-yl)sulfane
Wiley ID 1743662