CID 50986510

2-{6-bromo-1h-imidazo[4,5-b]pyridin-2-yl}propan-2-ol

Structural Information

Molecular Formula
C9H10BrN3O
SMILES
CC(C)(C1=NC2=C(N1)C=C(C=N2)Br)O
InChI
InChI=1S/C9H10BrN3O/c1-9(2,14)8-12-6-3-5(10)4-11-7(6)13-8/h3-4,14H,1-2H3,(H,11,12,13)
InChIKey
SRESEZQBIAQALA-UHFFFAOYSA-N
Compound name
2-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.00072 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.00800 148.9
[M+Na]+ 277.98994 162.9
[M-H]- 253.99344 150.9
[M+NH4]+ 273.03454 167.9
[M+K]+ 293.96388 150.7
[M+H-H2O]+ 237.99798 148.9
[M+HCOO]- 299.99892 165.2
[M+CH3COO]- 314.01457 186.5
[M+Na-2H]- 275.97539 157.7
[M]+ 255.00017 168.0
[M]- 255.00127 168.0
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

No patent data available for this compound.