CID 130094452
3-(difluoromethyl)-2-nitropyridine
Structural Information
- Molecular Formula
- C6H4F2N2O2
- SMILES
- C1=CC(=C(N=C1)[N+](=O)[O-])C(F)F
- InChI
- InChI=1S/C6H4F2N2O2/c7-5(8)4-2-1-3-9-6(4)10(11)12/h1-3,5H
- InChIKey
- SIOKMXYIQKHUGW-UHFFFAOYSA-N
- Compound name
- 3-(difluoromethyl)-2-nitropyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 175.03136 | 127.2 |
[M+Na]+ | 197.01330 | 135.6 |
[M-H]- | 173.01680 | 127.4 |
[M+NH4]+ | 192.05790 | 145.3 |
[M+K]+ | 212.98724 | 130.2 |
[M+H-H2O]+ | 157.02134 | 123.9 |
[M+HCOO]- | 219.02228 | 149.7 |
[M+CH3COO]- | 233.03793 | 173.6 |
[M+Na-2H]- | 194.99875 | 135.1 |
[M]+ | 174.02353 | 123.0 |
[M]- | 174.02463 | 123.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.