CID 79548

5452-83-5

Structural Information

Molecular Formula
C12H18N2
SMILES
C1CCN(CC1)CCC2=CC=CC=N2
InChI
InChI=1S/C12H18N2/c1-4-9-14(10-5-1)11-7-12-6-2-3-8-13-12/h2-3,6,8H,1,4-5,7,9-11H2
InChIKey
ZOXWZYTVCGKPOX-UHFFFAOYSA-N
Compound name
2-(2-piperidin-1-ylethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

44
Patents

190.147 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 145.6
[M+Na]+ 213.13622 158.8
[M+NH4]+ 208.18082 154.8
[M+K]+ 229.11016 150.5
[M-H]- 189.13972 149.5
[M+Na-2H]- 211.12167 154.3
[M]+ 190.14645 148.6
[M]- 190.14755 148.6
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