| SpectraBase Spectrum ID |
Dyx943gIqZY |
| Name |
2,2,2-Trifluoroethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxo-propyl]carbamoyl]cyclohexanecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
463.137335093 u |
| Formula |
C21H25ClF3NO5 |
| InChI |
InChI=1S/C21H25ClF3NO5/c1-2-30-18(27)11-17(15-9-5-6-10-16(15)22)26-19(28)13-7-3-4-8-14(13)20(29)31-12-21(23,24)25/h5-6,9-10,13-14,17H,2-4,7-8,11-12H2,1H3,(H,26,28) |
| InChIKey |
YETSFNAMGSRZAE-UHFFFAOYSA-N |
| Molecular Weight |
463.881 g/mol |
| SMILES |
C1(C(CCCC1)C(NC(CC(OCC)=O)C=1C(=CC=CC1)Cl)=O)C(OCC(F)(F)F)=O |
![2,2,2-Trifluoroethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxo-propyl]carbamoyl]cyclohexanecarboxylate](/api/spectrum/Dyx943gIqZY/structure.png?h=300&w=458 "2,2,2-Trifluoroethyl 2-[[1-(2-chlorophenyl)-3-ethoxy-3-oxo-propyl]carbamoyl]cyclohexanecarboxylate")
