CID 44383839
3-(3-fluorophenyl)-4,5,6,7-tetrahydro-2h-pyrazolo[4,3-c]pyridine
Structural Information
- Molecular Formula
- C12H12FN3
- SMILES
- C1CNCC2=C1NN=C2C3=CC(=CC=C3)F
- InChI
- InChI=1S/C12H12FN3/c13-9-3-1-2-8(6-9)12-10-7-14-5-4-11(10)15-16-12/h1-3,6,14H,4-5,7H2,(H,15,16)
- InChIKey
- UQWCTORHRVKVAN-UHFFFAOYSA-N
- Compound name
- 3-(3-fluorophenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 218.10881 | 147.2 |
[M+Na]+ | 240.09075 | 155.2 |
[M-H]- | 216.09425 | 146.6 |
[M+NH4]+ | 235.13535 | 162.9 |
[M+K]+ | 256.06469 | 148.7 |
[M+H-H2O]+ | 200.09879 | 137.7 |
[M+HCOO]- | 262.09973 | 161.9 |
[M+CH3COO]- | 276.11538 | 157.6 |
[M+Na-2H]- | 238.07620 | 151.5 |
[M]+ | 217.10098 | 140.0 |
[M]- | 217.10208 | 140.0 |