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2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetic acid
SpectraBase Compound ID 66sYAAoXJqf
InChI InChI=1S/C13H7F3N2O2S2/c14-13(15,16)8-4-9(10-2-1-3-21-10)18-12(7(8)5-17)22-6-11(19)20/h1-4H,6H2,(H,19,20)
InChIKey GUQAMDUAAGRUEP-UHFFFAOYSA-N
Mol Weight 344.33 g/mol
Molecular Formula C13H7F3N2O2S2
Exact Mass 343.990104 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ce5ur4GNF0G
Name 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H7F3N2O2S2
InChI InChI=1S/C13H7F3N2O2S2/c14-13(15,16)8-4-9(10-2-1-3-21-10)18-12(7(8)5-17)22-6-11(19)20/h1-4H,6H2,(H,19,20)
InChIKey GUQAMDUAAGRUEP-UHFFFAOYSA-N
Molecular Weight 344.326 g/mol
SMILES OC(CSc1c(c(C(F)(F)F)cc(n1)-c1sccc1)C#N)=O
SPLASH splash10-0f6t-6695000000-af7618dc7c305d9476b7
Synonyms 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoic acid 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetic acid 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]acetic acid 2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]acetic acid
Wiley ID 1452261