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3-Amino-4'-methoxy-5-methylsulfanylbiphenyl-2,4-dicarbonitrile
SpectraBase Compound ID 5LSQ9oWzEJV
InChI InChI=1S/C16H13N3OS/c1-20-11-5-3-10(4-6-11)12-7-15(21-2)14(9-18)16(19)13(12)8-17/h3-7H,19H2,1-2H3
InChIKey MLCQTSLXIHHKGE-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C16H13N3OS
Exact Mass 295.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6oGrmsaSzqu
Name 3-Amino-4'-methoxy-5-methylsulfanylbiphenyl-2,4-dicarbonitrile
Alternate Name(s) 2-Amino-4-(4-methoxyphenyl)-6-(methylthio)benzene-1,3-dicarbonitrile 2-Amino-4-(4-methoxyphenyl)-6-methylsulfanylbenzene-1,3-dicarbonitrile 2-Amino-4-(4-methoxyphenyl)-6-methylsulfanyl-benzene-1,3-dicarbonitrile 2-Azanyl-4-(4-methoxyphenyl)-6-methylsulfanyl-benzene-1,3-dicarbonitrile
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Formula C16H13N3OS
InChI InChI=1S/C16H13N3OS/c1-20-11-5-3-10(4-6-11)12-7-15(21-2)14(9-18)16(19)13(12)8-17/h3-7H,19H2,1-2H3
InChIKey MLCQTSLXIHHKGE-UHFFFAOYSA-N
Molecular Weight 295.360 g/mol
SMILES Nc1c(C#N)c(cc(c1C#N)SC)-c1ccc(cc1)OC
SPLASH splash10-0002-0090000000-1483fe26007636aa799f
Source of Spectrum Y-45-276-11c
Wiley ID 1666189