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6-(4-CHLOROPHENYL)-5-CYANO-2-ETHYL-(4H)-1,3-DITHIACYCLOHEXENE-4-THIONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

6-(4-CHLOROPHENYL)-5-CYANO-2-ETHYL-(4H)-1,3-DITHIACYCLOHEXENE-4-THIONE
SpectraBase Compound ID GvSSFTd6uu9
InChI InChI=1S/C13H10ClNS3/c1-2-11-17-12(10(7-15)13(16)18-11)8-3-5-9(14)6-4-8/h3-6,11H,2H2,1H3
InChIKey DFZLQSWDXHVZGB-UHFFFAOYSA-N
Mol Weight 311.86 g/mol
Molecular Formula C13H10ClNS3
Exact Mass 310.966391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7DZA9VLN6h
Name 4-(4-Chlorophenyl)-2-ethyl-6-sulfanylidene-1,3-dithiin-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10ClNS3
InChI InChI=1S/C13H10ClNS3/c1-2-11-17-12(10(7-15)13(16)18-11)8-3-5-9(14)6-4-8/h3-6,11H,2H2,1H3
InChIKey DFZLQSWDXHVZGB-UHFFFAOYSA-N
Molecular Weight 311.863 g/mol
SMILES C1(=C(SC(SC1=S)CC)c1ccc(cc1)Cl)C#N
SPLASH splash10-0bt9-1914000000-e4dc232aa1150cb33907
Source of Spectrum AJ-42-106-4
Synonyms 4-(4-Chlorophenyl)-2-ethyl-6-sulfanylidene-1,3-dithiine-5-carbonitrile 4-(4-Chlorophenyl)-2-ethyl-6-thioxo-1,3-dithiin-5-carbonitrile 4-(4-Chlorophenyl)-2-ethyl-6-thioxo-1,3-dithiine-5-carbonitrile
Wiley ID 1567770