SpectraBase Spectrum ID |
BB5yixBaA4B |
Name |
1-tert-Butyl-6-methyl-4-(pentafluoroethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H14F5N3 |
InChI |
InChI=1S/C15H14F5N3/c1-8-5-10(14(16,17)15(18,19)20)11-9(6-21)7-23(12(11)22-8)13(2,3)4/h5,7H,1-4H3 |
InChIKey |
DYPBFLFZAXMNPF-UHFFFAOYSA-N |
Molecular Weight |
331.290 g/mol |
SMILES |
c12[n](cc(c2c(C(C(F)(F)F)(F)F)cc(n1)C)C#N)C(C)(C)C |
SPLASH |
splash10-056r-1092000000-987227b6f545c8959ef3 |
Source of Spectrum |
F4-41-1854-12f |
Wiley ID |
1672362 |