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4-(4-Chlorophenyl)-2-(phenacylthio)-1-pyrindan-3-carbonitrile
SpectraBase Compound ID EJEJhK9mN7y
InChI InChI=1S/C23H17ClN2OS/c24-17-11-9-16(10-12-17)22-18-7-4-8-20(18)26-23(19(22)13-25)28-14-21(27)15-5-2-1-3-6-15/h1-3,5-6,9-12H,4,7-8,14H2
InChIKey FASHUEXFUKRQNM-UHFFFAOYSA-N
Mol Weight 404.92 g/mol
Molecular Formula C23H17ClN2OS
Exact Mass 404.075012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1L4pelE0UHn
Name 4-(4-Chlorophenyl)-2-(phenacylthio)-1-pyrindan-3-carbonitrile
Alternate Name(s) 4-(4-Chlorophenyl)-2-(phenacylthio)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 4-(4-Chlorophenyl)-2-phenacylsulfanyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
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Formula C23H17ClN2OS
InChI InChI=1S/C23H17ClN2OS/c24-17-11-9-16(10-12-17)22-18-7-4-8-20(18)26-23(19(22)13-25)28-14-21(27)15-5-2-1-3-6-15/h1-3,5-6,9-12H,4,7-8,14H2
InChIKey FASHUEXFUKRQNM-UHFFFAOYSA-N
Molecular Weight 404.915 g/mol
SMILES c1(c(nc2c(c1-c1ccc(cc1)Cl)CCC2)SCC(=O)c1ccccc1)C#N
SPLASH splash10-0a4i-2931000000-001c77253e1734a336ca
Wiley ID 1453268