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1-[2-(Methylthio)-1-phenylethyl]-4-phenyl-1H-1,2,3-triazole
SpectraBase Compound ID AZVMZbP83jx
InChI InChI=1S/C17H17N3S/c1-21-13-17(15-10-6-3-7-11-15)20-12-16(18-19-20)14-8-4-2-5-9-14/h2-12,17H,13H2,1H3
InChIKey IHIOHAZMVONADU-UHFFFAOYSA-N
Mol Weight 295.4 g/mol
Molecular Formula C17H17N3S
Exact Mass 295.114319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ckoD3OZyrg
Name 1-[2-(Methylthio)-1-phenylethyl]-4-phenyl-1H-1,2,3-triazole
Alternate Name(s) 1-(2-(methylthio)-1-phenylethyl)-4-phenyl-1H-1,2,3-triazole 1-[2-(methylthio)-1-phenylethyl]-4-phenyltriazole 1-(2-Methylsulfanyl-1-phenylethyl)-4-phenyltriazole 1-(2-Methylsulfanyl-1-phenyl-ethyl)-4-phenyl-triazole 1-(2-Methylsulfanyl-1-phenyl-ethyl)-4-phenyl-1,2,3-triazole
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Formula C17H17N3S
InChI InChI=1S/C17H17N3S/c1-21-13-17(15-10-6-3-7-11-15)20-12-16(18-19-20)14-8-4-2-5-9-14/h2-12,17H,13H2,1H3
InChIKey IHIOHAZMVONADU-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo400110m
Molecular Weight 295.404 g/mol
SMILES c1[n](nnc1-c1ccccc1)C(c1ccccc1)CSC
SPLASH splash10-0udi-3920000000-d22d15e12c28bf37c59e
Source of Spectrum J-78-5036-3ga
Wiley ID 1745446