CID 155937640
2-(6-chloropyrazin-2-yl)-2,2-difluoroacetic acid
Structural Information
- Molecular Formula
- C6H3ClF2N2O2
- SMILES
- C1=C(N=C(C=N1)Cl)C(C(=O)O)(F)F
- InChI
- InChI=1S/C6H3ClF2N2O2/c7-4-2-10-1-3(11-4)6(8,9)5(12)13/h1-2H,(H,12,13)
- InChIKey
- PGYGTMRZYGPEQR-UHFFFAOYSA-N
- Compound name
- 2-(6-chloropyrazin-2-yl)-2,2-difluoroacetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 208.99238 | 133.8 |
[M+Na]+ | 230.97432 | 144.1 |
[M-H]- | 206.97782 | 131.3 |
[M+NH4]+ | 226.01892 | 150.1 |
[M+K]+ | 246.94826 | 140.3 |
[M+H-H2O]+ | 190.98236 | 126.4 |
[M+HCOO]- | 252.98330 | 146.5 |
[M+CH3COO]- | 266.99895 | 179.8 |
[M+Na-2H]- | 228.95977 | 140.5 |
[M]+ | 207.98455 | 132.7 |
[M]- | 207.98565 | 132.7 |
Literature stripe
No literature data available for this compound.