CID 18321046

855778-84-6

Structural Information

Molecular Formula
C14H16N2O
SMILES
C1CNCCC1C2=CC3=CC=CC=C3NC2=O
InChI
InChI=1S/C14H16N2O/c17-14-12(10-5-7-15-8-6-10)9-11-3-1-2-4-13(11)16-14/h1-4,9-10,15H,5-8H2,(H,16,17)
InChIKey
KNBOBBCYHBUEHF-UHFFFAOYSA-N
Compound name
3-piperidin-4-yl-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

228
Patents

228.12627 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.133546 151.6
[M+Na]+ 251.115488 157.8
[M-H]- 227.118994 153.0
[M+NH4]+ 246.160093 166.2
[M+K]+ 267.089428 151.5
[M+H-H2O]+ 211.123530 143.0
[M+HCOO]- 273.124471 166.1
[M+CH3COO]- 287.140121 161.6
[M+Na-2H]- 249.100936 157.5
[M]+ 228.12572142 143.9
[M]- 228.12681858 143.9
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