CID 2727551

161467-87-4

Structural Information

Molecular Formula
C14H15ClN2
SMILES
C1CCN(CC1)C2=C3C=CC(=CC3=NC=C2)Cl
InChI
InChI=1S/C14H15ClN2/c15-11-4-5-12-13(10-11)16-7-6-14(12)17-8-2-1-3-9-17/h4-7,10H,1-3,8-9H2
InChIKey
FNCNNOMKQUPPIK-UHFFFAOYSA-N
Compound name
7-chloro-4-piperidin-1-ylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

15
Patents

246.09238 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.09966 154.8
[M+Na]+ 269.08160 162.3
[M-H]- 245.08510 158.4
[M+NH4]+ 264.12620 170.9
[M+K]+ 285.05554 156.1
[M+H-H2O]+ 229.08964 145.7
[M+HCOO]- 291.09058 167.1
[M+CH3COO]- 305.10623 165.6
[M+Na-2H]- 267.06705 160.8
[M]+ 246.09183 151.9
[M]- 246.09293 151.9
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