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1-(3,4-Dihydro-2H-quinolin-1-yl)-2-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-ethanone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(3,4-Dihydro-2H-quinolin-1-yl)-2-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-ethanone
SpectraBase Compound ID 8kS0Tgn4Tk9
InChI InChI=1S/C14H16N4OS/c1-17-10-15-16-14(17)20-9-13(19)18-8-4-6-11-5-2-3-7-12(11)18/h2-3,5,7,10H,4,6,8-9H2,1H3
InChIKey VEJDPDTYTCDFGA-UHFFFAOYSA-N
Mol Weight 288.37 g/mol
Molecular Formula C14H16N4OS
Exact Mass 288.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HrrHFolBtb
Name 1-(3,4-Dihydro-2H-quinolin-1-yl)-2-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-ethanone
Alternate Name(s) 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethanone 1-([(4-Methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl)-1,2,3,4-tetrahydroquinoline
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Formula C14H16N4OS
InChI InChI=1S/C14H16N4OS/c1-17-10-15-16-14(17)20-9-13(19)18-8-4-6-11-5-2-3-7-12(11)18/h2-3,5,7,10H,4,6,8-9H2,1H3
InChIKey VEJDPDTYTCDFGA-UHFFFAOYSA-N
Molecular Weight 288.369 g/mol
SMILES c1ccc2N(C(CSc3[n](cnn3)C)=O)CCCc2c1
SPLASH splash10-053r-4900000000-519a5c9be99dcc57d580
Wiley ID 1446416