CID 29997198

1-(5-chloropyridin-2-yl)piperidin-4-ol

Structural Information

Molecular Formula
C10H13ClN2O
SMILES
C1CN(CCC1O)C2=NC=C(C=C2)Cl
InChI
InChI=1S/C10H13ClN2O/c11-8-1-2-10(12-7-8)13-5-3-9(14)4-6-13/h1-2,7,9,14H,3-6H2
InChIKey
KCSIKVOTFWXEPG-UHFFFAOYSA-N
Compound name
1-(5-chloro-2-pyridinyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.07164 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.078916 145.1
[M+Na]+ 235.060858 152.5
[M-H]- 211.064364 147.0
[M+NH4]+ 230.105463 161.1
[M+K]+ 251.034798 147.7
[M+H-H2O]+ 195.068900 137.5
[M+HCOO]- 257.069841 157.8
[M+CH3COO]- 271.085491 156.3
[M+Na-2H]- 233.046306 149.8
[M]+ 212.07109142 141.7
[M]- 212.07218858 141.7
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