CID 53462

76180-96-6

Structural Information

Molecular Formula

C₁₁H₁₀N₄

SMILES

CN1C2=C(C3=C(C=C2)N=CC=C3)N=C1N

InChI

InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)

InChIKey

ARZWATDYIYAUTA-UHFFFAOYSA-N

Compound name

3-methylimidazo[4,5-f]quinolin-2-amine

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 239
References: 306
Patents: 198.09055 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	199.09783	140.7
[M+Na]+	221.07977	156.0
[M+NH4]+	216.12437	149.8
[M+K]+	237.05371	150.5
[M-H]-	197.08327	143.3
[M+Na-2H]-	219.06522	148.0
[M]+	198.09000	143.6
[M]-	198.09110	143.6

Literature stripe

literature stripe

Patent stripe

patents stripe