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

4
Patents

297.1841 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.19138 173.4
[M+Na]+ 320.17332 184.5
[M-H]- 296.17682 175.2
[M+NH4]+ 315.21792 189.3
[M+K]+ 336.14726 178.1
[M+H-H2O]+ 280.18136 164.2
[M+HCOO]- 342.18230 193.0
[M+CH3COO]- 356.19795 184.8
[M+Na-2H]- 318.15877 177.8
[M]+ 297.18355 179.8
[M]- 297.18465 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