CID 53418332
915030-04-5
Structural Information
- Molecular Formula
- C8H10F3N3O2
- SMILES
- CCOC(=O)C1=C(N(C=N1)CC(F)(F)F)N
- InChI
- InChI=1S/C8H10F3N3O2/c1-2-16-7(15)5-6(12)14(4-13-5)3-8(9,10)11/h4H,2-3,12H2,1H3
- InChIKey
- MTGXAJLRGLOVLI-UHFFFAOYSA-N
- Compound name
- ethyl 5-amino-1-(2,2,2-trifluoroethyl)imidazole-4-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 238.07979 | 146.7 |
[M+Na]+ | 260.06173 | 155.9 |
[M-H]- | 236.06523 | 144.0 |
[M+NH4]+ | 255.10633 | 163.3 |
[M+K]+ | 276.03567 | 153.9 |
[M+H-H2O]+ | 220.06977 | 137.4 |
[M+HCOO]- | 282.07071 | 165.0 |
[M+CH3COO]- | 296.08636 | 191.5 |
[M+Na-2H]- | 258.04718 | 149.0 |
[M]+ | 237.07196 | 144.3 |
[M]- | 237.07306 | 144.3 |
Literature stripe
No literature data available for this compound.