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4-Amino-2-chloro-9-methyl-7-phenylpyrido[3',2':4,5]thieno[3,2-b]pyridine-3-carbonitrile
SpectraBase Compound ID H72p7qg2tWW
InChI InChI=1S/C18H11ClN4S/c1-9-7-12(10-5-3-2-4-6-10)22-18-13(9)15-16(24-18)14(21)11(8-20)17(19)23-15/h2-7H,1H3,(H2,21,23)
InChIKey WJONJRZFJVXCQY-UHFFFAOYSA-N
Mol Weight 350.83 g/mol
Molecular Formula C18H11ClN4S
Exact Mass 350.039295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dw4yBvNePXg
Name 4-Amino-2-chloro-9-methyl-7-phenylpyrido[3',2':4,5]thieno[3,2-b]pyridine-3-carbonitrile
Appearance Black crystals
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Formula C18H11ClN4S
InChI InChI=1S/C18H11ClN4S/c1-9-7-12(10-5-3-2-4-6-10)22-18-13(9)15-16(24-18)14(21)11(8-20)17(19)23-15/h2-7H,1H3,(H2,21,23)
InChIKey WJONJRZFJVXCQY-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3810
Molecular Weight 350.827 g/mol
SMILES Nc1c2sc3nc(cc(c3c2nc(c1C#N)Cl)C)-c1ccccc1
SPLASH splash10-0udi-9413000000-c81f8c1757d281345961
Source of Spectrum Y-57-SM79-32
Wiley ID 1860018