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2-Benzoyl-N-(4-chlorophenyl)thieno[2,3-b]pyridinium Bromide
SpectraBase Compound ID 3epF5x5KOJj
InChI InChI=1S/C20H13ClNOS.BrH/c21-16-8-10-17(11-9-16)22-12-4-7-15-13-18(24-20(15)22)19(23)14-5-2-1-3-6-14;/h1-13H;1H/q+1;/p-1
InChIKey LTZXSOGLZLSCIN-UHFFFAOYSA-M
Mol Weight 430.75 g/mol
Molecular Formula C20H13BrClNOS
Exact Mass 428.958976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8n9GcOTeCm5
Name 2-Benzoyl-N-(4-chlorophenyl)thieno[2,3-b]pyridinium Bromide
Alternate Name(s) 2-Benzoyl-7-(4-chlorophenyl)thieno[2,3-b]pyridin-7-ium bromide 6-Benzoyl-N-(4-chlorophenyl)thieno[2,3-b]pyridinium Bromide
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Formula C20H13BrClNOS
InChI InChI=1S/C20H13ClNOS.BrH/c21-16-8-10-17(11-9-16)22-12-4-7-15-13-18(24-20(15)22)19(23)14-5-2-1-3-6-14;/h1-13H;1H/q+1;/p-1
InChIKey LTZXSOGLZLSCIN-UHFFFAOYSA-M
Molecular Weight 430.747 g/mol
SMILES [Br-].c12[n+](-c3ccc(Cl)cc3)cccc2cc(s1)C(=O)c1ccccc1
SPLASH splash10-0udi-0009000000-2802d6db2657d558c606
Source of Spectrum SO-0-343-3
Wiley ID 1538842