For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-1,3-Benzimidazole, 2-[[(5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-
SpectraBase Compound ID FBFbZe1UbTf
InChI InChI=1S/C11H11N5S/c1-7-12-11(16-15-7)17-6-10-13-8-4-2-3-5-9(8)14-10/h2-5H,6H2,1H3,(H,13,14)(H,12,15,16)
InChIKey VVGZOUNSQYXDBG-UHFFFAOYSA-N
Mol Weight 245.3 g/mol
Molecular Formula C11H11N5S
Exact Mass 245.073517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6kIc6Nh0SiR
Name 1H-1,3-Benzimidazole, 2-[[(5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N5S
InChI InChI=1S/C11H11N5S/c1-7-12-11(16-15-7)17-6-10-13-8-4-2-3-5-9(8)14-10/h2-5H,6H2,1H3,(H,13,14)(H,12,15,16)
InChIKey VVGZOUNSQYXDBG-UHFFFAOYSA-N
Molecular Weight 245.304 g/mol
SMILES [nH]1c(SCc2[nH]c3c(n2)cccc3)nnc1C
SPLASH splash10-001j-7940000000-658b27f9b9d1d5aeba0c
Synonyms 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole 2-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1H-benzimidazole 2-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-benzimidazole
Wiley ID 1449199