CID 3077211

4h-imidazo(4,5-c)quinolin-4-one, 3,5-dihydro-3,5-dibutyl-, monohydrochloride

Structural Information

Molecular Formula
C18H23N3O
SMILES
CCCCN1C=NC2=C1C(=O)N(C3=CC=CC=C32)CCCC
InChI
InChI=1S/C18H23N3O/c1-3-5-11-20-13-19-16-14-9-7-8-10-15(14)21(12-6-4-2)18(22)17(16)20/h7-10,13H,3-6,11-12H2,1-2H3
InChIKey
GLVBNIQCBVICCM-UHFFFAOYSA-N
Compound name
3,5-dibutylimidazo[4,5-c]quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

297.1841 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.191376 173.4
[M+Na]+ 320.173318 184.5
[M-H]- 296.176824 175.2
[M+NH4]+ 315.217923 189.3
[M+K]+ 336.147258 178.1
[M+H-H2O]+ 280.181360 164.2
[M+HCOO]- 342.182301 193.0
[M+CH3COO]- 356.197951 184.8
[M+Na-2H]- 318.158766 177.8
[M]+ 297.18355142 179.8
[M]- 297.18464858 179.8
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

patents stripe