CID 63032699

2770359-60-7

Structural Information

Molecular Formula
C10H12N4
SMILES
C1CNCC1C2=NC3=C(N2)C=CC=N3
InChI
InChI=1S/C10H12N4/c1-2-8-10(12-4-1)14-9(13-8)7-3-5-11-6-7/h1-2,4,7,11H,3,5-6H2,(H,12,13,14)
InChIKey
XPWLECMZGZDPGJ-UHFFFAOYSA-N
Compound name
2-pyrrolidin-3-yl-1H-imidazo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1
Patents

188.1062 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.113476 139.8
[M+Na]+ 211.095418 148.5
[M-H]- 187.098924 139.9
[M+NH4]+ 206.140023 157.1
[M+K]+ 227.069358 143.5
[M+H-H2O]+ 171.103460 131.0
[M+HCOO]- 233.104401 157.3
[M+CH3COO]- 247.120051 151.3
[M+Na-2H]- 209.080866 144.3
[M]+ 188.10565142 135.5
[M]- 188.10674858 135.5
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