CID 124252415
2307778-74-9
Structural Information
- Molecular Formula
- C8H12F3N
- SMILES
- C1C[C@H]2CNC[C@]2(C1)C(F)(F)F
- InChI
- InChI=1S/C8H12F3N/c9-8(10,11)7-3-1-2-6(7)4-12-5-7/h6,12H,1-5H2/t6-,7-/m0/s1
- InChIKey
- UAEDCNSUHWNQRT-BQBZGAKWSA-N
- Compound name
- (3aR,6aR)-3a-(trifluoromethyl)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 180.09946 | 137.4 |
[M+Na]+ | 202.08140 | 144.5 |
[M-H]- | 178.08490 | 134.9 |
[M+NH4]+ | 197.12600 | 161.6 |
[M+K]+ | 218.05534 | 141.6 |
[M+H-H2O]+ | 162.08944 | 130.4 |
[M+HCOO]- | 224.09038 | 151.8 |
[M+CH3COO]- | 238.10603 | 174.9 |
[M+Na-2H]- | 200.06685 | 140.7 |
[M]+ | 179.09163 | 127.8 |
[M]- | 179.09273 | 127.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.