CID 3077212

4h-imidazo(4,5-c)quinolin-4-one, 3,5-dihydro-5-butyl-3-(2-oxopropyl)-

Structural Information

Molecular Formula
C17H19N3O2
SMILES
CCCCN1C2=CC=CC=C2C3=C(C1=O)N(C=N3)CC(=O)C
InChI
InChI=1S/C17H19N3O2/c1-3-4-9-20-14-8-6-5-7-13(14)15-16(17(20)22)19(11-18-15)10-12(2)21/h5-8,11H,3-4,9-10H2,1-2H3
InChIKey
VOZXIXLPADWIDQ-UHFFFAOYSA-N
Compound name
5-butyl-3-(2-oxopropyl)imidazo[4,5-c]quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

297.14774 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.15502 169.9
[M+Na]+ 320.13696 184.7
[M+NH4]+ 315.18156 176.8
[M+K]+ 336.11090 178.9
[M-H]- 296.14046 170.7
[M+Na-2H]- 318.12241 174.6
[M]+ 297.14719 172.2
[M]- 297.14829 172.2
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