CID 50987378

6-bromo-2-(oxolan-2-yl)-4h-imidazo[4,5-b]pyridine

Structural Information

Molecular Formula
C10H10BrN3O
SMILES
C1CC(OC1)C2=NC3=C(N2)C=C(C=N3)Br
InChI
InChI=1S/C10H10BrN3O/c11-6-4-7-9(12-5-6)14-10(13-7)8-2-1-3-15-8/h4-5,8H,1-3H2,(H,12,13,14)
InChIKey
ISQJHJLODREZKE-UHFFFAOYSA-N
Compound name
6-bromo-2-(oxolan-2-yl)-1H-imidazo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.00073 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.00801 150.8
[M+Na]+ 289.98995 163.9
[M-H]- 265.99345 157.3
[M+NH4]+ 285.03455 169.9
[M+K]+ 305.96389 153.7
[M+H-H2O]+ 249.99799 150.2
[M+HCOO]- 311.99893 168.5
[M+CH3COO]- 326.01458 165.3
[M+Na-2H]- 287.97540 156.7
[M]+ 267.00018 168.9
[M]- 267.00128 168.9
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

No patent data available for this compound.