![N-[3-(Trifluoromethyl)phenyl]urea, N-acetyl-](/api/spectrum/9u9B5SdrJaf/structure.png?h=300&w=458 "N-[3-(Trifluoromethyl)phenyl]urea, N-acetyl-")
| SpectraBase Compound ID | JsDiDEOGneY |
|---|---|
| InChI | InChI=1S/C10H9F3N2O2/c1-6(16)14-9(17)15-8-4-2-3-7(5-8)10(11,12)13/h2-5H,1H3,(H2,14,15,16,17) |
| InChIKey | PNHQBZMLTHIAHW-UHFFFAOYSA-N |
| Mol Weight | 246.19 g/mol |
| Molecular Formula | C10H9F3N2O2 |
| Exact Mass | 246.061612 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9u9B5SdrJaf |
|---|---|
| Name | N-[3-(Trifluoromethyl)phenyl]urea, N-acetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.061612025 u |
| Formula | C10H9F3N2O2 |
| InChI | InChI=1S/C10H9F3N2O2/c1-6(16)14-9(17)15-8-4-2-3-7(5-8)10(11,12)13/h2-5H,1H3,(H2,14,15,16,17) |
| InChIKey | PNHQBZMLTHIAHW-UHFFFAOYSA-N |
| Molecular Weight | 246.189 g/mol |
| SMILES | C(F)(F)(F)C1=CC(=CC=C1)NC(=O)NC(C)=O |