| SpectraBase Spectrum ID |
GbUYy8SBJnT |
| Name |
1,1-Dicyclohexyl-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.207547985 u |
| Formula |
C20H27F3N2O |
| InChI |
InChI=1S/C20H27F3N2O/c21-20(22,23)15-8-7-9-16(14-15)24-19(26)25(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h7-9,14,17-18H,1-6,10-13H2,(H,24,26) |
| InChIKey |
BEQVNFDAKPQLCT-UHFFFAOYSA-N |
| Molecular Weight |
368.444 g/mol |
| SMILES |
N(C1=CC=CC(=C1)C(F)(F)F)C(N(C1CCCCC1)C1CCCCC1)=O |
| Spectrum/Structure Validation Score (Raman) |
0.904613 |
