CID 18671441

1215739-41-5

Structural Information

Molecular Formula
C9H12N4
SMILES
C1=CC2=C(N=C1)N=C(N2)CCCN
InChI
InChI=1S/C9H12N4/c10-5-1-4-8-12-7-3-2-6-11-9(7)13-8/h2-3,6H,1,4-5,10H2,(H,11,12,13)
InChIKey
DPYVQLWNTYSHEW-UHFFFAOYSA-N
Compound name
3-(1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

176.1062 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.113476 136.3
[M+Na]+ 199.095418 145.9
[M-H]- 175.098924 135.5
[M+NH4]+ 194.140023 154.4
[M+K]+ 215.069358 141.4
[M+H-H2O]+ 159.103460 128.4
[M+HCOO]- 221.104401 158.0
[M+CH3COO]- 235.120051 148.8
[M+Na-2H]- 197.080866 144.4
[M]+ 176.10565142 135.6
[M]- 176.10674858 135.6
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