CID 119014877
1105985-15-6
Structural Information
- Molecular Formula
- C7H4ClF2NO2
- SMILES
- C1=CC(=NC(=C1C(=O)O)Cl)C(F)F
- InChI
- InChI=1S/C7H4ClF2NO2/c8-5-3(7(12)13)1-2-4(11-5)6(9)10/h1-2,6H,(H,12,13)
- InChIKey
- WKZVVMZDNPKOOW-UHFFFAOYSA-N
- Compound name
- 2-chloro-6-(difluoromethyl)pyridine-3-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 207.99715 | 132.8 |
[M+Na]+ | 229.97909 | 143.1 |
[M-H]- | 205.98259 | 131.7 |
[M+NH4]+ | 225.02369 | 150.7 |
[M+K]+ | 245.95303 | 139.2 |
[M+H-H2O]+ | 189.98713 | 126.1 |
[M+HCOO]- | 251.98807 | 147.3 |
[M+CH3COO]- | 266.00372 | 181.8 |
[M+Na-2H]- | 227.96454 | 136.4 |
[M]+ | 206.98932 | 132.1 |
[M]- | 206.99042 | 132.1 |
Literature stripe
No literature data available for this compound.