CID 16787048

1-(5-chloropyridin-2-yl)piperidine-4-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C11H13ClN2O2
SMILES
C1CN(CCC1C(=O)O)C2=NC=C(C=C2)Cl
InChI
InChI=1S/C11H13ClN2O2/c12-9-1-2-10(13-7-9)14-5-3-8(4-6-14)11(15)16/h1-2,7-8H,3-6H2,(H,15,16)
InChIKey
YOSRZAOSDZTMAM-UHFFFAOYSA-N
Compound name
1-(5-chloropyridin-2-yl)piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

240.06656 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.07384 151.1
[M+Na]+ 263.05578 164.2
[M+NH4]+ 258.10038 158.7
[M+K]+ 279.02972 157.8
[M-H]- 239.05928 153.1
[M+Na-2H]- 261.04123 157.6
[M]+ 240.06601 153.6
[M]- 240.06711 153.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe