CID 10655065

172648-09-8

Structural Information

Molecular Formula
C7H6ClN3O
SMILES
C1=CC(=NC2=C1NC(=N2)CO)Cl
InChI
InChI=1S/C7H6ClN3O/c8-5-2-1-4-7(10-5)11-6(3-12)9-4/h1-2,12H,3H2,(H,9,10,11)
InChIKey
GOIUTMAEZUWPGD-UHFFFAOYSA-N
Compound name
(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

183.01994 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.027216 133.2
[M+Na]+ 206.009158 145.6
[M-H]- 182.012664 131.9
[M+NH4]+ 201.053763 151.9
[M+K]+ 221.983098 140.0
[M+H-H2O]+ 166.017200 126.7
[M+HCOO]- 228.018141 149.0
[M+CH3COO]- 242.033791 146.4
[M+Na-2H]- 203.994606 141.0
[M]+ 183.01939142 135.2
[M]- 183.02048858 135.2
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