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4-(2-TRIFLUOROMETHYLPHENYL)-3,5-DIMETHYL-1,7-DIPHENYL-1H,7H-BISPYRAZOLO-[3,4-B:4',3'-E]-PYRIDINE
SpectraBase Compound ID CO8EFpuBIdI
InChI InChI=1S/C28H20F3N5/c1-17-23-25(21-15-9-10-16-22(21)28(29,30)31)24-18(2)34-36(20-13-7-4-8-14-20)27(24)32-26(23)35(33-17)19-11-5-3-6-12-19/h3-16H,1-2H3
InChIKey LLUNXPLHDBTGNE-UHFFFAOYSA-N
Mol Weight 483.5 g/mol
Molecular Formula C28H20F3N5
Exact Mass 483.16708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PM8vfycxC0
Name 3,5-Dimethyl-4-[2"-(trifluoromethyl)phenyl]-1,7-diphenyl-1H,7H-bis(pyrazolo)-[3,4-b : 4',3'-e]pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20F3N5
InChI InChI=1S/C28H20F3N5/c1-17-23-25(21-15-9-10-16-22(21)28(29,30)31)24-18(2)34-36(20-13-7-4-8-14-20)27(24)32-26(23)35(33-17)19-11-5-3-6-12-19/h3-16H,1-2H3
InChIKey LLUNXPLHDBTGNE-UHFFFAOYSA-N
Molecular Weight 483.498 g/mol
SMILES c12c(c(-c3c(C(F)(F)F)cccc3)c3c(n1)[n](nc3C)-c1ccccc1)c(C)n[n]2-c1ccccc1
SPLASH splash10-001i-1000900000-318427ef0c76983fa035
Source of Spectrum AJ-42-64-3
Wiley ID 1567736