CID 56773837
5-chloro-2-(1h-pyrrol-1-yl)-4-(trifluoromethyl)aniline
Structural Information
- Molecular Formula
- C11H8ClF3N2
- SMILES
- C1=CN(C=C1)C2=C(C=C(C(=C2)C(F)(F)F)Cl)N
- InChI
- InChI=1S/C11H8ClF3N2/c12-8-6-9(16)10(17-3-1-2-4-17)5-7(8)11(13,14)15/h1-6H,16H2
- InChIKey
- HWKWADYVFZUQOR-UHFFFAOYSA-N
- Compound name
- 5-chloro-2-pyrrol-1-yl-4-(trifluoromethyl)aniline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 261.04008 | 153.7 |
[M+Na]+ | 283.02202 | 164.0 |
[M+NH4]+ | 278.06662 | 159.9 |
[M+K]+ | 298.99596 | 159.6 |
[M-H]- | 259.02552 | 152.6 |
[M+Na-2H]- | 281.00747 | 159.3 |
[M]+ | 260.03225 | 154.9 |
[M]- | 260.03335 | 154.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.