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Benzonitrile, 2-[(phenyl-2-thienylmethylene)amino]-, (E)-
SpectraBase Compound ID YACXF3IRbF
InChI InChI=1S/C18H12N2S/c19-13-15-9-4-5-10-16(15)20-18(17-11-6-12-21-17)14-7-2-1-3-8-14/h1-12H/b20-18-
InChIKey GNNCPJPBMIQUEM-ZZEZOPTASA-N
Mol Weight 288.37 g/mol
Molecular Formula C18H12N2S
Exact Mass 288.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XuMGvvajhY
Name Benzonitrile, 2-[(phenyl-2-thienylmethylene)amino]-, (E)-
Alternate Name(s) 2-[{phenyl(2-thienyl)methylene}amino]benzonitrile 2-{[(Z)-phenyl(2-thienyl)methylidene]amino}benzonitrile
CAS Registry Number 125743-44-4
Comments Less than 3 mono-isotopic peaks
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Formula C18H12N2S
InChI InChI=1S/C18H12N2S/c19-13-15-9-4-5-10-16(15)20-18(17-11-6-12-21-17)14-7-2-1-3-8-14/h1-12H/b20-18-
InChIKey GNNCPJPBMIQUEM-ZZEZOPTASA-N
Molecular Weight 288.368 g/mol
SMILES c1(\C(=N/c2c(C#N)cccc2)c2ccccc2)sccc1
SPLASH splash10-000i-0090000000-070452571f6bad79f64f
Source of Spectrum Y-26-926-4
Wiley ID 1291929