CID 3243078
1-(pyridine-3-sulfonyl)piperidine-4-carboxylic acid
Structural Information
- Molecular Formula
- C11H14N2O4S
- SMILES
- C1CN(CCC1C(=O)O)S(=O)(=O)C2=CN=CC=C2
- InChI
- InChI=1S/C11H14N2O4S/c14-11(15)9-3-6-13(7-4-9)18(16,17)10-2-1-5-12-8-10/h1-2,5,8-9H,3-4,6-7H2,(H,14,15)
- InChIKey
- RBKAABCGXZKFCH-UHFFFAOYSA-N
- Compound name
- 1-pyridin-3-ylsulfonylpiperidine-4-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 271.07468 | 157.8 |
[M+Na]+ | 293.05662 | 163.7 |
[M-H]- | 269.06012 | 160.0 |
[M+NH4]+ | 288.10122 | 170.5 |
[M+K]+ | 309.03056 | 160.4 |
[M+H-H2O]+ | 253.06466 | 150.2 |
[M+HCOO]- | 315.06560 | 168.5 |
[M+CH3COO]- | 329.08125 | 189.0 |
[M+Na-2H]- | 291.04207 | 160.5 |
[M]+ | 270.06685 | 155.9 |
[M]- | 270.06795 | 155.9 |
Literature stripe
Patent stripe
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