CID 18369291

1-{3h-imidazo[4,5-c]quinolin-2-yl}methanamine dihydrochloride

Structural Information

Molecular Formula
C11H10N4
SMILES
C1=CC=C2C(=C1)C3=C(C=N2)NC(=N3)CN
InChI
InChI=1S/C11H10N4/c12-5-10-14-9-6-13-8-4-2-1-3-7(8)11(9)15-10/h1-4,6H,5,12H2,(H,14,15)
InChIKey
NKVLLSXYCVOPMQ-UHFFFAOYSA-N
Compound name
3H-imidazo[4,5-c]quinolin-2-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

198.09055 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.09783 140.4
[M+Na]+ 221.07977 151.6
[M-H]- 197.08327 141.1
[M+NH4]+ 216.12437 158.8
[M+K]+ 237.05371 145.7
[M+H-H2O]+ 181.08781 132.6
[M+HCOO]- 243.08875 161.3
[M+CH3COO]- 257.10440 153.2
[M+Na-2H]- 219.06522 149.8
[M]+ 198.09000 139.9
[M]- 198.09110 139.9
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