CID 115222

108043-88-5

Structural Information

Molecular Formula
C11H10N4O
SMILES
CN1C2=C(C3=C(C=C2)NC(=O)C=C3)N=C1N
InChI
InChI=1S/C11H10N4O/c1-15-8-4-3-7-6(2-5-9(16)13-7)10(8)14-11(15)12/h2-5H,1H3,(H2,12,14)(H,13,16)
InChIKey
RRWYTKOWRFCKBO-UHFFFAOYSA-N
Compound name
2-amino-3-methyl-6H-imidazo[4,5-f]quinolin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

34
Patents

214.08546 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.09274 145.1
[M+Na]+ 237.07468 158.3
[M-H]- 213.07818 146.6
[M+NH4]+ 232.11928 163.3
[M+K]+ 253.04862 152.3
[M+H-H2O]+ 197.08272 137.7
[M+HCOO]- 259.08366 166.3
[M+CH3COO]- 273.09931 158.3
[M+Na-2H]- 235.06013 152.8
[M]+ 214.08491 146.0
[M]- 214.08601 146.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe