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2-(2-Chloro-benzylsulfanyl)-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID 4qEyQ2Ym3jw
InChI InChI=1S/C15H15ClN4S/c1-9-10(2)17-14-18-15(19-20(14)11(9)3)21-8-12-6-4-5-7-13(12)16/h4-7H,8H2,1-3H3
InChIKey NESUSBSYWDTIDF-UHFFFAOYSA-N
Mol Weight 318.83 g/mol
Molecular Formula C15H15ClN4S
Exact Mass 318.070595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4cfb5g2rIn
Name 2-(2-Chloro-benzylsulfanyl)-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
Alternate Name(s) 2-Chlorobenzyl 5,6,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl sulfide 2-[(2-chlorophenyl)methylthio]-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine 2-[(2-chlorophenyl)methylsulfanyl]-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
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Formula C15H15ClN4S
InChI InChI=1S/C15H15ClN4S/c1-9-10(2)17-14-18-15(19-20(14)11(9)3)21-8-12-6-4-5-7-13(12)16/h4-7H,8H2,1-3H3
InChIKey NESUSBSYWDTIDF-UHFFFAOYSA-N
Molecular Weight 318.826 g/mol
SMILES c12[n](C(C)=C(C(=N2)C)C)nc(n1)SCc1c(Cl)cccc1
SPLASH splash10-001i-3490000000-0173f3fa71d4848257b9
Wiley ID 1452257