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2-(4'-Chlorophenyl)-4,6-dicyano-7-hydroxy-5-methylthiopyrazolo[1,5-a]pyridine
SpectraBase Compound ID 3rEqkT3nUwQ
InChI InChI=1S/C16H9ClN4OS/c1-23-15-11(7-18)14-6-13(9-2-4-10(17)5-3-9)20-21(14)16(22)12(15)8-19/h2-6,22H,1H3
InChIKey RTJIYSHDRFEEAB-UHFFFAOYSA-N
Mol Weight 340.79 g/mol
Molecular Formula C16H9ClN4OS
Exact Mass 340.01856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDYFHjRL5e
Name 2-(4'-Chlorophenyl)-4,6-dicyano-7-hydroxy-5-methylthiopyrazolo[1,5-a]pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C16H9ClN4OS
InChI InChI=1S/C16H9ClN4OS/c1-23-15-11(7-18)14-6-13(9-2-4-10(17)5-3-9)20-21(14)16(22)12(15)8-19/h2-6,22H,1H3
InChIKey RTJIYSHDRFEEAB-UHFFFAOYSA-N
Molecular Weight 340.788 g/mol
SMILES OC1=C(C(=C(c2[n]1nc(c2)-c1ccc(cc1)Cl)C#N)SC)C#N
SPLASH splash10-0006-0009000000-13d3c1ada4236bef57b6
Source of Spectrum U1-1998-2086-6
Synonyms 2-(4-chlorophenyl)-7-hydroxy-5-(methylsulfanyl)pyrazolo[1,5-a]pyridine-4,6-dicarbonitrile
Wiley ID 751694