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1H-1,2,4-Triazole, 3-methyl-5-[[[3-[[(3-methyl-1H-1,2,4-triazol-5-yl)thio]methyl]phenyl]methyl]thio]-
SpectraBase Compound ID 94RVCVRCabd
InChI InChI=1S/C14H16N6S2/c1-9-15-13(19-17-9)21-7-11-4-3-5-12(6-11)8-22-14-16-10(2)18-20-14/h3-6H,7-8H2,1-2H3,(H,15,17,19)(H,16,18,20)
InChIKey GVLLLLJNSDVYDG-UHFFFAOYSA-N
Mol Weight 332.44 g/mol
Molecular Formula C14H16N6S2
Exact Mass 332.087787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHO58z4P6jX
Name 1H-1,2,4-Triazole, 3-methyl-5-[[[3-[[(3-methyl-1H-1,2,4-triazol-5-yl)thio]methyl]phenyl]methyl]thio]-
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Formula C14H16N6S2
InChI InChI=1S/C14H16N6S2/c1-9-15-13(19-17-9)21-7-11-4-3-5-12(6-11)8-22-14-16-10(2)18-20-14/h3-6H,7-8H2,1-2H3,(H,15,17,19)(H,16,18,20)
InChIKey GVLLLLJNSDVYDG-UHFFFAOYSA-N
Molecular Weight 332.444 g/mol
SMILES [nH]1c(SCc2cc(CSc3nc(n[nH]3)C)ccc2)nc(C)n1
SPLASH splash10-0gbc-9530000000-00728dfd8b5a620582b7
Source of Spectrum IY-2-4839-1
Synonyms 5-Methyl-3-[[3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]methylthio]-1H-1,2,4-triazole 5-Methyl-3-[[3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1H-1,2,4-triazole
Wiley ID 1656374