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6-[(4-chlorophenyl)thio]-5-cyano-2-(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester
SpectraBase Compound ID EWUkWOlxNTd
InChI InChI=1S/C16H10ClF3N2O2S/c1-2-24-15(23)12-7-9(8-21)14(22-13(12)16(18,19)20)25-11-5-3-10(17)4-6-11/h3-7H,2H2,1H3
InChIKey BZADFKGBVDORFD-UHFFFAOYSA-N
Mol Weight 386.78 g/mol
Molecular Formula C16H10ClF3N2O2S
Exact Mass 386.010361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CpwUhweixJ
Name 6-[(4-chlorophenyl)thio]-5-cyano-2-(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10ClF3N2O2S
InChI InChI=1S/C16H10ClF3N2O2S/c1-2-24-15(23)12-7-9(8-21)14(22-13(12)16(18,19)20)25-11-5-3-10(17)4-6-11/h3-7H,2H2,1H3
InChIKey BZADFKGBVDORFD-UHFFFAOYSA-N
Molecular Weight 386.776 g/mol
SMILES c1(c(nc(c(c1)C#N)Sc1ccc(cc1)Cl)C(F)(F)F)C(=O)OCC
SPLASH splash10-000l-8839000000-bd71b057885647215e6e
Synonyms 6-[(4-chlorophenyl)thio]-5-cyano-2-(trifluoromethyl)nicotinic acid ethyl ester Ethyl 6-(4-chlorophenyl)sulfanyl-5-cyano-2-(trifluoromethyl)pyridine-3-carboxylate
Wiley ID 1452539