CID 3351962
1-[(4-fluorophenyl)methyl]piperidine-2-carboxylic acid
Structural Information
- Molecular Formula
- C13H16FNO2
- SMILES
- C1CCN(C(C1)C(=O)O)CC2=CC=C(C=C2)F
- InChI
- InChI=1S/C13H16FNO2/c14-11-6-4-10(5-7-11)9-15-8-2-1-3-12(15)13(16)17/h4-7,12H,1-3,8-9H2,(H,16,17)
- InChIKey
- WRCCKEVVICUODU-UHFFFAOYSA-N
- Compound name
- 1-[(4-fluorophenyl)methyl]piperidine-2-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 238.12378 | 152.9 |
[M+Na]+ | 260.10572 | 158.3 |
[M-H]- | 236.10922 | 154.8 |
[M+NH4]+ | 255.15032 | 168.2 |
[M+K]+ | 276.07966 | 154.7 |
[M+H-H2O]+ | 220.11376 | 144.3 |
[M+HCOO]- | 282.11470 | 169.0 |
[M+CH3COO]- | 296.13035 | 189.2 |
[M+Na-2H]- | 258.09117 | 154.8 |
[M]+ | 237.11595 | 147.2 |
[M]- | 237.11705 | 147.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.