CID 16227474
1-(5-cyanopyridin-2-yl)piperidine-4-carboxylic acid
Structural Information
- Molecular Formula
- C12H13N3O2
- SMILES
- C1CN(CCC1C(=O)O)C2=NC=C(C=C2)C#N
- InChI
- InChI=1S/C12H13N3O2/c13-7-9-1-2-11(14-8-9)15-5-3-10(4-6-15)12(16)17/h1-2,8,10H,3-6H2,(H,16,17)
- InChIKey
- DKTWMVJYYKLZRD-UHFFFAOYSA-N
- Compound name
- 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 232.10805 | 155.1 |
[M+Na]+ | 254.08999 | 166.3 |
[M+NH4]+ | 249.13459 | 158.5 |
[M+K]+ | 270.06393 | 157.6 |
[M-H]- | 230.09349 | 149.5 |
[M+Na-2H]- | 252.07544 | 158.2 |
[M]+ | 231.10022 | 154.1 |
[M]- | 231.10132 | 154.1 |
Literature stripe
No literature data available for this compound.