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4-{2-[(4-Chlorophenyl)thio]ethyl}pyridine
SpectraBase Compound ID 9xt0EgW2UVl
InChI InChI=1S/C13H12ClNS/c14-12-1-3-13(4-2-12)16-10-7-11-5-8-15-9-6-11/h1-6,8-9H,7,10H2
InChIKey YGWOXNOUFKRAPE-UHFFFAOYSA-N
Mol Weight 249.76 g/mol
Molecular Formula C13H12ClNS
Exact Mass 249.037898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwLFVJmsfOM
Name 4-{2-[(4-Chlorophenyl)thio]ethyl}pyridine
Alternate Name(s) 4-(2-((4-Chlorophenyl)thio)ethyl)pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClNS
InChI InChI=1S/C13H12ClNS/c14-12-1-3-13(4-2-12)16-10-7-11-5-8-15-9-6-11/h1-6,8-9H,7,10H2
InChIKey YGWOXNOUFKRAPE-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c1ra00401h
Molecular Weight 249.759 g/mol
SMILES c1cc(ccn1)CCSc1ccc(cc1)Cl
SPLASH splash10-0a4j-3940000000-acd837bf1d31a579b175
Source of Spectrum RSA-1-1111-Table3,entry12
Wiley ID 1747775