CID 214919
34580-76-2
Structural Information
- Molecular Formula
- C14H10F3N3O
- SMILES
- COC1=NN(C2=C1C=CC=N2)C3=CC=CC(=C3)C(F)(F)F
- InChI
- InChI=1S/C14H10F3N3O/c1-21-13-11-6-3-7-18-12(11)20(19-13)10-5-2-4-9(8-10)14(15,16)17/h2-8H,1H3
- InChIKey
- DXCSAORYPUTKOU-UHFFFAOYSA-N
- Compound name
- 3-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 294.08488 | 163.2 |
[M+Na]+ | 316.06682 | 175.5 |
[M-H]- | 292.07032 | 164.2 |
[M+NH4]+ | 311.11142 | 177.7 |
[M+K]+ | 332.04076 | 169.7 |
[M+H-H2O]+ | 276.07486 | 151.6 |
[M+HCOO]- | 338.07580 | 180.8 |
[M+CH3COO]- | 352.09145 | 174.7 |
[M+Na-2H]- | 314.05227 | 169.0 |
[M]+ | 293.07705 | 163.5 |
[M]- | 293.07815 | 163.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.