| SpectraBase Spectrum ID |
5Geim69R4OG |
| Name |
1-[ 4'-(Dimethylamino)phenyl]-1-[2'-(trifluoromethyl)phenyl]-3-phenyl-2-propyn-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.149698756 u |
| Formula |
C24H20F3NO |
| InChI |
InChI=1S/C24H20F3NO/c1-28(2)20-14-12-19(13-15-20)23(29,17-16-18-8-4-3-5-9-18)21-10-6-7-11-22(21)24(25,26)27/h3-15,29H,1-2H3 |
| InChIKey |
WCWSJMOVJOMQRF-UHFFFAOYSA-N |
| Molecular Weight |
395.425 g/mol |
| SMILES |
C(C(C=1C(C(F)(F)F)=CC=CC1)(C1=CC=C(C=C1)N(C)C)O)#CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.822973 |
![1-[ 4'-(Dimethylamino)phenyl]-1-[2'-(trifluoromethyl)phenyl]-3-phenyl-2-propyn-1-ol](/api/spectrum/5Geim69R4OG/structure.png?h=300&w=458 "1-[ 4'-(Dimethylamino)phenyl]-1-[2'-(trifluoromethyl)phenyl]-3-phenyl-2-propyn-1-ol")
