CID 58482996
2-(difluoromethyl)-4-fluoroaniline hydrochloride
Structural Information
- Molecular Formula
- C7H6F3N
- SMILES
- C1=CC(=C(C=C1F)C(F)F)N
- InChI
- InChI=1S/C7H6F3N/c8-4-1-2-6(11)5(3-4)7(9)10/h1-3,7H,11H2
- InChIKey
- GMOKYLWICVYFLS-UHFFFAOYSA-N
- Compound name
- 2-(difluoromethyl)-4-fluoroaniline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 162.05251 | 126.8 |
[M+Na]+ | 184.03445 | 136.0 |
[M-H]- | 160.03795 | 126.7 |
[M+NH4]+ | 179.07905 | 147.3 |
[M+K]+ | 200.00839 | 133.3 |
[M+H-H2O]+ | 144.04249 | 118.9 |
[M+HCOO]- | 206.04343 | 148.2 |
[M+CH3COO]- | 220.05908 | 180.8 |
[M+Na-2H]- | 182.01990 | 130.9 |
[M]+ | 161.04468 | 120.8 |
[M]- | 161.04578 | 120.8 |
Literature stripe
No literature data available for this compound.