SpectraBase Spectrum ID |
744NS6lWLfP |
Name |
2-Methoxy-1-methyl-5,7-diphenyl-1,3,4-triazolo[3,2-a]pyridinium trifluoromethanesulfonate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H18F3N3O4S |
InChI |
InChI=1S/C20H18N3O.CHF3O3S/c1-22-19-14-17(15-9-5-3-6-10-15)13-18(16-11-7-4-8-12-16)23(19)21-20(22)24-2;2-1(3,4)8(5,6)7/h3-14H,1-2H3;(H,5,6,7)/q+1;/p-1 |
InChIKey |
NQJDAQPLWVYQER-UHFFFAOYSA-M |
Molecular Weight |
465.447 g/mol |
SMILES |
C(S([O-])(=O)=O)(F)(F)F.c12[n+](nc([n]2C)OC)c(cc(c1)-c1ccccc1)-c1ccccc1 |
SPLASH |
splash10-0udi-0089000000-9a02f689586a1e72bcf2 |
Source of Spectrum |
K-121-1499-10 |
Synonyms |
2-Methoxy-1-methyl-5,7-diphenyl-1H-[1,2,4]triazolo[1,5-a]pyridin-4-ium trifluoromethanesulfonate |
Wiley ID |
1391689 |