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3-([2-(4-Bromophenyl)-2-oxoethyl]sulfanyl)-6-methyl-1,2,4-triazin-5(4H)-one
SpectraBase Compound ID ExqYV3RunCV
InChI InChI=1S/C12H10BrN3O2S/c1-7-11(18)14-12(16-15-7)19-6-10(17)8-2-4-9(13)5-3-8/h2-5H,6H2,1H3,(H,14,16,18)
InChIKey UMUTWILFJUVXQA-UHFFFAOYSA-N
Mol Weight 340.2 g/mol
Molecular Formula C12H10BrN3O2S
Exact Mass 338.967711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wo1uZPYtfM
Name 3-([2-(4-Bromophenyl)-2-oxoethyl]sulfanyl)-6-methyl-1,2,4-triazin-5(4H)-one
Alternate Name(s) 3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one 3-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one 3-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one 3-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one Ethanone, 1-(4-bromophenyl)-2-(4,5-dihydro-5-oxo-6-methyl-1,2,4-triazin-3-yl)thio-
CAS Registry Number 339196-72-4
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Formula C12H10BrN3O2S
InChI InChI=1S/C12H10BrN3O2S/c1-7-11(18)14-12(16-15-7)19-6-10(17)8-2-4-9(13)5-3-8/h2-5H,6H2,1H3,(H,14,16,18)
InChIKey UMUTWILFJUVXQA-UHFFFAOYSA-N
Molecular Weight 340.195 g/mol
SMILES N1C(=NN=C(C1=O)C)SCC(c1ccc(Br)cc1)=O
SPLASH splash10-0019-4910000000-c193c85b37fca0c7fa11
Source of Spectrum AD-0-2532-0
Wiley ID 1421175