CID 57343

Brn 1543191

Structural Information

Molecular Formula
C16H22N2O2
SMILES
C1CCN(CC1)CCN2C(=O)CCC3=C2C=C(C=C3)O
InChI
InChI=1S/C16H22N2O2/c19-14-6-4-13-5-7-16(20)18(15(13)12-14)11-10-17-8-2-1-3-9-17/h4,6,12,19H,1-3,5,7-11H2
InChIKey
UZCJRXDWHJBDGB-UHFFFAOYSA-N
Compound name
7-hydroxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.16812 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.17540 166.3
[M+Na]+ 297.15734 170.7
[M-H]- 273.16084 168.2
[M+NH4]+ 292.20194 179.6
[M+K]+ 313.13128 165.9
[M+H-H2O]+ 257.16538 156.8
[M+HCOO]- 319.16632 178.8
[M+CH3COO]- 333.18197 175.0
[M+Na-2H]- 295.14279 168.6
[M]+ 274.16757 160.0
[M]- 274.16867 160.0
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.