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3-Phenethyl-1-tosyl-1,2,4-triazole
SpectraBase Compound ID 196vhye0Stg
InChI InChI=1S/C17H17N3O2S/c1-14-7-10-16(11-8-14)23(21,22)20-13-18-17(19-20)12-9-15-5-3-2-4-6-15/h2-8,10-11,13H,9,12H2,1H3
InChIKey YGWWKRBJIDWZGD-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C17H17N3O2S
Exact Mass 327.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kUonyG3BRn
Name 3-Phenethyl-1-tosyl-1,2,4-triazole
Alternate Name(s) 3-(2-phenylethyl)-1-(p-tolylsulfonyl)-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N3O2S
InChI InChI=1S/C17H17N3O2S/c1-14-7-10-16(11-8-14)23(21,22)20-13-18-17(19-20)12-9-15-5-3-2-4-6-15/h2-8,10-11,13H,9,12H2,1H3
InChIKey YGWWKRBJIDWZGD-UHFFFAOYSA-N
Molecular Weight 327.402 g/mol
SMILES c1(S([n]2nc(CCc3ccccc3)nc2)(=O)=O)ccc(cc1)C
SPLASH splash10-00dl-8900000000-7921959149b64fdc8593
Source of Spectrum Y-29-1865-8
Wiley ID 1325463