CID 3062243

80443-07-8

Structural Information

Molecular Formula
C16H19ClN2
SMILES
C1CC(CNC1)CCC2=C(C=NC3=CC=CC=C32)Cl
InChI
InChI=1S/C16H19ClN2/c17-15-11-19-16-6-2-1-5-14(16)13(15)8-7-12-4-3-9-18-10-12/h1-2,5-6,11-12,18H,3-4,7-10H2
InChIKey
IGJLTOQNHJAOAG-UHFFFAOYSA-N
Compound name
3-chloro-4-(2-piperidin-3-ylethyl)quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

274.1237 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13098 164.4
[M+Na]+ 297.11292 179.8
[M+NH4]+ 292.15752 174.1
[M+K]+ 313.08686 169.8
[M-H]- 273.11642 169.0
[M+Na-2H]- 295.09837 172.4
[M]+ 274.12315 168.3
[M]- 274.12425 168.3
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