CID 3058856

4-quinolinol, 6-chloro-2-(1-piperidinyl)-

Structural Information

Molecular Formula
C14H15ClN2O
SMILES
C1CCN(CC1)C2=CC(=O)C3=C(N2)C=CC(=C3)Cl
InChI
InChI=1S/C14H15ClN2O/c15-10-4-5-12-11(8-10)13(18)9-14(16-12)17-6-2-1-3-7-17/h4-5,8-9H,1-3,6-7H2,(H,16,18)
InChIKey
SVBLIRYYPFKLQL-UHFFFAOYSA-N
Compound name
6-chloro-2-piperidin-1-yl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.08728 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.09456 157.8
[M+Na]+ 285.07650 166.1
[M-H]- 261.08000 160.6
[M+NH4]+ 280.12110 172.8
[M+K]+ 301.05044 159.1
[M+H-H2O]+ 245.08454 149.4
[M+HCOO]- 307.08548 169.1
[M+CH3COO]- 321.10113 168.3
[M+Na-2H]- 283.06195 162.7
[M]+ 262.08673 154.4
[M]- 262.08783 154.4
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

No patent data available for this compound.