SpectraBase Spectrum ID |
Hm69chZqPp |
Name |
3-Tert-butyl-1-phenyl-N-[4-(trifluoromethyl)benzyl]-1H-pyrazol-5-amine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
373.176582209 u |
Formula |
C21H22F3N3 |
InChI |
InChI=1S/C21H22F3N3/c1-20(2,3)18-13-19(27(26-18)17-7-5-4-6-8-17)25-14-15-9-11-16(12-10-15)21(22,23)24/h4-13,25H,14H2,1-3H3 |
InChIKey |
AOWULQZWGQVMCQ-UHFFFAOYSA-N |
Molecular Weight |
373.423 g/mol |
SMILES |
C=1(N(N=C(C1)C(C)(C)C)C=1C=CC=CC1)NCC=1C=CC(C(F)(F)F)=CC1 |