CID 63757458

{3-methyl-3h-imidazo[4,5-b]pyridin-2-yl}methanamine dihydrochloride

Structural Information

Molecular Formula
C8H10N4
SMILES
CN1C(=NC2=C1N=CC=C2)CN
InChI
InChI=1S/C8H10N4/c1-12-7(5-9)11-6-3-2-4-10-8(6)12/h2-4H,5,9H2,1H3
InChIKey
JCLJGQJDGHEXKW-UHFFFAOYSA-N
Compound name
(3-methylimidazo[4,5-b]pyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

162.09055 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.09783 132.1
[M+Na]+ 185.07977 143.6
[M-H]- 161.08327 133.2
[M+NH4]+ 180.12437 151.8
[M+K]+ 201.05371 140.1
[M+H-H2O]+ 145.08781 124.4
[M+HCOO]- 207.08875 155.6
[M+CH3COO]- 221.10440 146.1
[M+Na-2H]- 183.06522 140.4
[M]+ 162.09000 133.3
[M]- 162.09110 133.3
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