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4-(4-Chlorophenyl)-2-(ethylsulfonyl)-3-thiophenecarbonitrile
SpectraBase Compound ID 7Cpda9KgrkQ
InChI InChI=1S/C13H10ClNO2S2/c1-2-19(16,17)13-11(7-15)12(8-18-13)9-3-5-10(14)6-4-9/h3-6,8H,2H2,1H3
InChIKey VYKJXJBBYQBGDY-UHFFFAOYSA-N
Mol Weight 311.8 g/mol
Molecular Formula C13H10ClNO2S2
Exact Mass 310.984149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3lo4nAjVda
Name 4-(4-Chlorophenyl)-2-(ethylsulfonyl)-3-thiophenecarbonitrile
CAS Registry Number 116526-62-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10ClNO2S2
InChI InChI=1S/C13H10ClNO2S2/c1-2-19(16,17)13-11(7-15)12(8-18-13)9-3-5-10(14)6-4-9/h3-6,8H,2H2,1H3
InChIKey VYKJXJBBYQBGDY-UHFFFAOYSA-N
Molecular Weight 311.801 g/mol
SMILES c1(c(S(=O)(=O)CC)scc1-c1ccc(Cl)cc1)C#N
SPLASH splash10-03dr-0739000000-ba9a1470d4dae871d78f
Source of Spectrum AD-0-2532-0
Synonyms 4-(4-Chlorophenyl)-2-esyl-thiophene-3-carbonitrile 4-(4-Chlorophenyl)-2-ethylsulfonyl-thiophene-3-carbonitrile Thiophene-3-carbonitrile, 4-(4-chlorophenyl)-2-ethylsulfonyl)- 4-(4-Chlorophenyl)-2-ethylsulfonyl-3-thiophenecarbonitrile
Wiley ID 1429483