7-Phenyl-1-methyl-3,6-bis(methylthio)-1,2,4-triazolo[4,3-b]-1,2,4-triazolium iodide

SpectraBase Compound ID	2BBYzKdSunk
InChI	InChI=1S/C12H14N5S2.HI/c1-15-12-16(9-7-5-4-6-8-9)10(18-2)14-17(12)11(13-15)19-3;/h4-8H,1-3H3;1H/q+1;/p-1
InChIKey	MOFLASCPZJGOKF-UHFFFAOYSA-M Google Search
Mol Weight	419.3 g/mol
Molecular Formula	C12H14IN5S2
Exact Mass	418.973533 g/mol

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SpectraBase Spectrum ID	6cIl8z9vYpf
Name	7-Phenyl-1-methyl-3,6-bis(methylthio)-1,2,4-triazolo[4,3-b]-1,2,4-triazolium iodide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H14IN5S2
InChI	InChI=1S/C12H14N5S2.HI/c1-15-12-16(9-7-5-4-6-8-9)10(18-2)14-17(12)11(13-15)19-3;/h4-8H,1-3H3;1H/q+1;/p-1
InChIKey	MOFLASCPZJGOKF-UHFFFAOYSA-M
Molecular Weight	419.303 g/mol
SMILES	[I-].c12[n+](nc([n]2-c2ccccc2)SC)c(n[n]1C)SC
SPLASH	splash10-004m-6930000000-70330309e9096dc4bddd
Source of Spectrum	F-42-2126-3
Synonyms	1-Methyl-3,6-bis(methylsulfanyl)-7-phenyl-1H,7H-[1,2,4]triazolo[5,1-c][1,2,4]triazol-4-ium iodide 1-Methyl-3,6-dimethylthio-7-phenyl-1,2,4-triazolo(4,3-b)-1,2,4-triazol-4-ium iodide
Wiley ID	1377525