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(E)-ethylidene-[2-(methylthio)-4-phenyl-imidazol-1-yl]amine
SpectraBase Compound ID AtUNoVztpK6
InChI InChI=1S/C12H13N3S/c1-3-13-15-9-11(14-12(15)16-2)10-7-5-4-6-8-10/h3-9H,1-2H3/b13-3+
InChIKey CPDPKCKHXNMEAI-QLKAYGNNSA-N
Mol Weight 231.32 g/mol
Molecular Formula C12H13N3S
Exact Mass 231.083019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OghX9WhqRG
Name (E)-ethylidene-[2-(methylthio)-4-phenyl-imidazol-1-yl]amine
Alternate Name(s) (E)-N-[2-(methylthio)-4-phenyl-1-imidazolyl]ethanimine (E)-N-(2-methylsulfanyl-4-phenylimidazol-1-yl)ethanimine
CAS Registry Number 132397-40-1
Comments Less than 3 mono-isotopic peaks
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Formula C12H13N3S
InChI InChI=1S/C12H13N3S/c1-3-13-15-9-11(14-12(15)16-2)10-7-5-4-6-8-10/h3-9H,1-2H3/b13-3+
InChIKey CPDPKCKHXNMEAI-QLKAYGNNSA-N
Molecular Weight 231.317 g/mol
SMILES c1(nc(c[n]1\N=C\C)-c1ccccc1)SC
SPLASH splash10-001r-0590000000-6da9838e01e0664b6d12
Source of Spectrum KC-1990-3087-2
Wiley ID 1232693