| SpectraBase Spectrum ID |
CCrPmjDMPoF |
| Name |
Ethyl (E)-1-(3,3,3-trifluoroprop-1-en-1-yl)-1H-imidazole-4-carboxylate |
| Appearance |
White powder |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.061612025 u |
| Formula |
C9H9F3N2O2 |
| GC Column |
HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| InChI |
InChI=1S/C9H9F3N2O2/c1-2-16-8(15)7-5-14(6-13-7)4-3-9(10,11)12/h3-6H,2H2,1H3/b4-3+ |
| InChIKey |
RVSSCYYIPPYMEU-ONEGZZNKSA-N |
| Instrument Name |
Agilent 6890N-Agilent 5973 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202102840 |
| Molecular Weight |
234.178 g/mol |
| Quality |
236 |
| Reported Formula |
C9H9N2O2F3 |
| SMILES |
C(C)OC(=O)C=1N=CN(C1)\C=C\C(F)(F)F |
| SPLASH |
splash10-01p9-0910000000-b3887aa48a35d81f00a8 |
| Source of Spectrum |
QE-27-SM35-27 (DOI: 10.1002/chem.202102840) |
| Thin-Layer Chromatography |
0.33 (hexanes/EtOAc, 1:1) |
| Wiley ID |
1904231 |
