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4-((2,4-Dichlorophenoxy)methyl)-[1,2,4]triazolo[4,3-d]-[1,2,3,4]thiatriazole
SpectraBase Compound ID 6mieV59H2SA
InChI InChI=1S/C9H5Cl2N5OS/c10-5-1-2-7(6(11)3-5)17-4-8-12-13-9-16(8)14-15-18-9/h1-3H,4H2
InChIKey LYUXXPPPXZCFOC-UHFFFAOYSA-N
Mol Weight 302.14 g/mol
Molecular Formula C9H5Cl2N5OS
Exact Mass 300.959186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eg66Ix2JGs2
Name 4-((2,4-Dichlorophenoxy)methyl)-[1,2,4]triazolo[4,3-d]-[1,2,3,4]thiatriazole
Comments Less than 3 mono-isotopic peaks
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Formula C9H5Cl2N5OS
InChI InChI=1S/C9H5Cl2N5OS/c10-5-1-2-7(6(11)3-5)17-4-8-12-13-9-16(8)14-15-18-9/h1-3H,4H2
InChIKey LYUXXPPPXZCFOC-UHFFFAOYSA-N
Molecular Weight 302.139 g/mol
SMILES c12[n](c(nn2)COc2c(cc(cc2)Cl)Cl)N=NS1
SPLASH splash10-0udi-0009000000-d50f1dba4f54f68b428f
Source of Spectrum Y-45-1908-10
Synonyms 6-[[2,4-bis(chloranyl)phenoxy]methyl]-[1,2,4]triazolo[4,3-d][1,2,3,4]thiatriazole
Wiley ID 1704480