CID 342999

909768-32-7

Structural Information

Molecular Formula
C8H8BrN3O
SMILES
CC(C1=NC2=C(N1)C=C(C=N2)Br)O
InChI
InChI=1S/C8H8BrN3O/c1-4(13)7-11-6-2-5(9)3-10-8(6)12-7/h2-4,13H,1H3,(H,10,11,12)
InChIKey
FZDJGAPRDIWTCF-UHFFFAOYSA-N
Compound name
1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

240.98508 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.99236 142.2
[M+Na]+ 263.97430 156.0
[M-H]- 239.97780 144.1
[M+NH4]+ 259.01890 161.5
[M+K]+ 279.94824 144.0
[M+H-H2O]+ 223.98234 141.8
[M+HCOO]- 285.98328 159.4
[M+CH3COO]- 299.99893 156.6
[M+Na-2H]- 261.95975 149.9
[M]+ 240.98453 160.9
[M]- 240.98563 160.9
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