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5-[[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole
SpectraBase Compound ID 5KVYFgUnXXN
InChI InChI=1S/C12H12N6S2/c1-2-10(6-20-12-14-8-16-18-12)4-3-9(1)5-19-11-13-7-15-17-11/h1-4,7-8H,5-6H2,(H,13,15,17)(H,14,16,18)
InChIKey PAZRPGAWBXLEAJ-UHFFFAOYSA-N
Mol Weight 304.39 g/mol
Molecular Formula C12H12N6S2
Exact Mass 304.056487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBrECB1d5VL
Name 5-[[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole
Alternate Name(s) 5-[[4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzyl]thio]-1H-1,2,4-triazole 5-[[4-[(1H-1,2,4-triazol-5-ylthio)methyl]phenyl]methylthio]-1H-1,2,4-triazole Benzene, 1,4-di(4H-1,2,4-triazol-3-ylthiomethyl)-
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Formula C12H12N6S2
InChI InChI=1S/C12H12N6S2/c1-2-10(6-20-12-14-8-16-18-12)4-3-9(1)5-19-11-13-7-15-17-11/h1-4,7-8H,5-6H2,(H,13,15,17)(H,14,16,18)
InChIKey PAZRPGAWBXLEAJ-UHFFFAOYSA-N
Molecular Weight 304.390 g/mol
SMILES [nH]1cnnc1SCc1ccc(CSc2[nH]cnn2)cc1
SPLASH splash10-0udi-4890000000-a3fb9545f0ca3e068834
Wiley ID 1459818