| SpectraBase Spectrum ID |
9yZXEi9NcrS |
| Name |
Ethyl 5-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3H-imidazole-4-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.087826773 u |
| Formula |
C14H13F3N2O3 |
| InChI |
InChI=1S/C14H13F3N2O3/c1-3-22-12(20)11-8(2)19(13(21)18-11)10-6-4-5-9(7-10)14(15,16)17/h4-7H,3H2,1-2H3,(H,18,21) |
| InChIKey |
WLAYTNNRDLEAJL-UHFFFAOYSA-N |
| Molecular Weight |
314.264 g/mol |
| SMILES |
C(C1=CC=CC(N2C(NC(C(OCC)=O)=C2C)=O)=C1)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960047 |
![Ethyl 5-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3H-imidazole-4-carboxylate](/api/spectrum/9yZXEi9NcrS/structure.png?h=300&w=458 "Ethyl 5-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3H-imidazole-4-carboxylate")
