CID 516432

1-ethyl-6-isopropyl-2-(2-pyridyl)quinolin-4-one

Structural Information

Molecular Formula
C19H20N2O
SMILES
CCN1C2=C(C=C(C=C2)C(C)C)C(=O)C=C1C3=CC=CC=N3
InChI
InChI=1S/C19H20N2O/c1-4-21-17-9-8-14(13(2)3)11-15(17)19(22)12-18(21)16-7-5-6-10-20-16/h5-13H,4H2,1-3H3
InChIKey
ANWUYKRUZCKPPT-UHFFFAOYSA-N
Compound name
1-ethyl-6-propan-2-yl-2-pyridin-2-ylquinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.15756 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 170.5
[M+Na]+ 315.14678 179.9
[M-H]- 291.15028 175.7
[M+NH4]+ 310.19138 184.5
[M+K]+ 331.12072 174.1
[M+H-H2O]+ 275.15482 160.8
[M+HCOO]- 337.15576 189.5
[M+CH3COO]- 351.17141 181.8
[M+Na-2H]- 313.13223 174.9
[M]+ 292.15701 172.5
[M]- 292.15811 172.5
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.