CID 477660

4-(piperidin-1-yl)pyridine-2-carbonitrile

Structural Information

Molecular Formula
C11H13N3
SMILES
C1CCN(CC1)C2=CC(=NC=C2)C#N
InChI
InChI=1S/C11H13N3/c12-9-10-8-11(4-5-13-10)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2
InChIKey
KUNVHZKYKVYNCK-UHFFFAOYSA-N
Compound name
4-piperidin-1-ylpyridine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

187.11095 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.11823 139.4
[M+Na]+ 210.10017 147.3
[M-H]- 186.10367 141.2
[M+NH4]+ 205.14477 153.9
[M+K]+ 226.07411 142.7
[M+H-H2O]+ 170.10821 124.1
[M+HCOO]- 232.10915 154.4
[M+CH3COO]- 246.12480 149.5
[M+Na-2H]- 208.08562 145.0
[M]+ 187.11040 129.6
[M]- 187.11150 129.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe