3-((2,4-Dichlorophenoxy)methyl)-6-(2,4-dinitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

SpectraBase Compound ID	Ky0l0cpHwKG
InChI	InChI=1S/C16H8Cl2N6O5S/c17-8-1-4-13(11(18)5-8)29-7-14-19-20-16-22(14)21-15(30-16)10-3-2-9(23(25)26)6-12(10)24(27)28/h1-6H,7H2
InChIKey	FKNWPBVODUMBPZ-UHFFFAOYSA-N Google Search
Mol Weight	467.24 g/mol
Molecular Formula	C16H8Cl2N6O5S
Exact Mass	465.965394 g/mol

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SpectraBase Spectrum ID	LWjYNU2M8bp
Name	3-((2,4-Dichlorophenoxy)methyl)-6-(2,4-dinitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H8Cl2N6O5S
InChI	InChI=1S/C16H8Cl2N6O5S/c17-8-1-4-13(11(18)5-8)29-7-14-19-20-16-22(14)21-15(30-16)10-3-2-9(23(25)26)6-12(10)24(27)28/h1-6H,7H2
InChIKey	FKNWPBVODUMBPZ-UHFFFAOYSA-N
Molecular Weight	467.243 g/mol
SMILES	c12[n](N=C(S2)c2c(N(=O)=O)cc(N(=O)=O)cc2)c(nn1)COc1c(cc(cc1)Cl)Cl
SPLASH	splash10-014i-0000900000-52e7946edad2d9253a3f
Source of Spectrum	Y-45-1908-4a
Synonyms	3-[[2,4-bis(chloranyl)phenoxy]methyl]-6-(2,4-dinitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID	1704489