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2-(methylthio)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
SpectraBase Compound ID L36DjGKFVjz
InChI InChI=1S/C16H12N4OS/c1-22-16-18-20-14(21)12-9-5-6-10-13(12)17-15(20)19(16)11-7-3-2-4-8-11/h2-10H,1H3
InChIKey AIKNPQOMEQTFTF-UHFFFAOYSA-N
Mol Weight 308.36 g/mol
Molecular Formula C16H12N4OS
Exact Mass 308.073182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JuOVBjbVPtm
Name 2-(methylthio)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Alternate Name(s) 2-Methylsulfanyl-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4OS
InChI InChI=1S/C16H12N4OS/c1-22-16-18-20-14(21)12-9-5-6-10-13(12)17-15(20)19(16)11-7-3-2-4-8-11/h2-10H,1H3
InChIKey AIKNPQOMEQTFTF-UHFFFAOYSA-N
Molecular Weight 308.359 g/mol
SMILES C12=Nc3ccccc3C(N2N=C(N1c1ccccc1)SC)=O
SPLASH splash10-052f-2296000000-8c75b351673003647639
Source of Spectrum K1-2004-3877-15
Wiley ID 1561570