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

*Links on SpectraBase are not permalinks.
8-[[1-(2-bromobenzyl)-1,2,4-triazol-3-yl]thio]-1,3,7-trimethyl-xanthine
SpectraBase Compound ID GK3j10I1juP
InChI InChI=1S/C17H16BrN7O2S/c1-22-12-13(23(2)17(27)24(3)14(12)26)20-16(22)28-15-19-9-25(21-15)8-10-6-4-5-7-11(10)18/h4-7,9H,8H2,1-3H3
InChIKey ZPGNSXQVOWDJGA-UHFFFAOYSA-N
Mol Weight 462.33 g/mol
Molecular Formula C17H16BrN7O2S
Exact Mass 461.026957 g/mol
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.