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2-Methoxy-1-methyl-5,7-diphenyl-1,3,4-triazolo[3,2-a]pyridinium trifluoromethanesulfonate
SpectraBase Compound ID GxXESHEnMWe
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
Mol Weight 465.45 g/mol
Molecular Formula C21H18F3N3O4S
Exact Mass 465.097012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 744NS6lWLfP
Name 2-Methoxy-1-methyl-5,7-diphenyl-1,3,4-triazolo[3,2-a]pyridinium trifluoromethanesulfonate
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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