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1-(benzenesulfonyl)-3-phenethyl-1,2,4-triazole
SpectraBase Compound ID JpK4egIIG1Q
InChI InChI=1S/C16H15N3O2S/c20-22(21,15-9-5-2-6-10-15)19-13-17-16(18-19)12-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2
InChIKey MRXZSVZNXOTZCA-UHFFFAOYSA-N
Mol Weight 313.38 g/mol
Molecular Formula C16H15N3O2S
Exact Mass 313.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtOjbuztd9U
Name 1-(benzenesulfonyl)-3-phenethyl-1,2,4-triazole
Alternate Name(s) 1-besyl-3-phenethyl-1,2,4-triazole 3-(2-phenylethyl)-1-(phenylsulfonyl)-1H-1,2,4-triazole 1-(benzenesulfonyl)-3-(2-phenylethyl)-1,2,4-triazole
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Formula C16H15N3O2S
InChI InChI=1S/C16H15N3O2S/c20-22(21,15-9-5-2-6-10-15)19-13-17-16(18-19)12-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2
InChIKey MRXZSVZNXOTZCA-UHFFFAOYSA-N
Molecular Weight 313.375 g/mol
SMILES c1(S([n]2nc(CCc3ccccc3)nc2)(=O)=O)ccccc1
SPLASH splash10-00dl-9500000000-fd067a507f1a0ea77b3d
Source of Spectrum Y-29-1864-7
Wiley ID 1314167