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2-[(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-1-phenylethanone
SpectraBase Compound ID 7ngfeNzSk0k
InChI InChI=1S/C15H14N4OS/c1-10-8-11(2)19-14(16-10)17-18-15(19)21-9-13(20)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey PCJDGLWWXGZPPM-UHFFFAOYSA-N
Mol Weight 298.36 g/mol
Molecular Formula C15H14N4OS
Exact Mass 298.088832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7pnYWT8BA5d
Name 2-[(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-1-phenylethanone
Alternate Name(s) 2-[(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]-1-phenyl-ethanone Ethanone, 2-(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-ylsulfanyl)-1-phenyl- 2-[(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]-1-phenylethanone 2-[(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-1-phenylethanone
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Formula C15H14N4OS
InChI InChI=1S/C15H14N4OS/c1-10-8-11(2)19-14(16-10)17-18-15(19)21-9-13(20)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey PCJDGLWWXGZPPM-UHFFFAOYSA-N
Molecular Weight 298.364 g/mol
SMILES c12[n](c(SCC(=O)c3ccccc3)nn1)C(C)=CC(=N2)C
SPLASH splash10-0a4i-7910000000-813bcb6efda2e4ed24d8
Wiley ID 1441735