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3-(2-Chlorobenzyl)-5-(2-thienyl)-7-(trifluoromethyl)-3H-imidazo[4,5-b]pyridine
SpectraBase Compound ID GQBJXoD2gpt
InChI InChI=1S/C18H11ClF3N3S/c19-13-5-2-1-4-11(13)9-25-10-23-16-12(18(20,21)22)8-14(24-17(16)25)15-6-3-7-26-15/h1-8,10H,9H2
InChIKey RVZXVTBDWKNOFR-UHFFFAOYSA-N
Mol Weight 393.82 g/mol
Molecular Formula C18H11ClF3N3S
Exact Mass 393.031431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqrgZpUlzZ1
Name 3-(2-Chlorobenzyl)-5-(2-thienyl)-7-(trifluoromethyl)-3H-imidazo[4,5-b]pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11ClF3N3S
InChI InChI=1S/C18H11ClF3N3S/c19-13-5-2-1-4-11(13)9-25-10-23-16-12(18(20,21)22)8-14(24-17(16)25)15-6-3-7-26-15/h1-8,10H,9H2
InChIKey RVZXVTBDWKNOFR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200221
Molecular Weight 393.815 g/mol
SMILES c12nc(cc(c1nc[n]2Cc1c(cccc1)Cl)C(F)(F)F)-c1sccc1
SPLASH splash10-0a4i-0109000000-60340fcbefb158a5c81e
Source of Spectrum ASC-354-n/a/SM7-5f
Synonyms 3-(2-Chlorobenzyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)-3H-imidazo[4,5-b]pyridine
Wiley ID 1762662