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ethyl-2-(3-((2,4-dichlorophenoxy)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)acetate
SpectraBase Compound ID 3cpy3N4UJ5L
InChI InChI=1S/C14H12Cl2N4O3S/c1-2-22-13(21)6-12-19-20-11(17-18-14(20)24-12)7-23-10-4-3-8(15)5-9(10)16/h3-5H,2,6-7H2,1H3
InChIKey PPTLWMWXFPLEIJ-UHFFFAOYSA-N
Mol Weight 387.24 g/mol
Molecular Formula C14H12Cl2N4O3S
Exact Mass 386.000717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7cPBxzTJmP
Name ethyl-2-(3-((2,4-dichlorophenoxy)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)acetate
Alternate Name(s) ethyl 2-[3-[(2,4-dichlorophenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetate ethyl 2-[3-[[2,4-bis(chloranyl)phenoxy]methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethanoate
Comments Less than 3 mono-isotopic peaks
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Formula C14H12Cl2N4O3S
InChI InChI=1S/C14H12Cl2N4O3S/c1-2-22-13(21)6-12-19-20-11(17-18-14(20)24-12)7-23-10-4-3-8(15)5-9(10)16/h3-5H,2,6-7H2,1H3
InChIKey PPTLWMWXFPLEIJ-UHFFFAOYSA-N
Molecular Weight 387.241 g/mol
SMILES c12[n](N=C(S2)CC(=O)OCC)c(nn1)COc1c(cc(cc1)Cl)Cl
SPLASH splash10-000i-0009000000-67d229d851590c3ab0f2
Source of Spectrum Y-45-1908-7
Wiley ID 1704484