CID 82530858

Ethyl 3-amino-8-bromo-6-fluoroimidazo[1,2-a]pyridine-2-carboxylate

Structural Information

Molecular Formula
C10H9BrFN3O2
SMILES
CCOC(=O)C1=C(N2C=C(C=C(C2=N1)Br)F)N
InChI
InChI=1S/C10H9BrFN3O2/c1-2-17-10(16)7-8(13)15-4-5(12)3-6(11)9(15)14-7/h3-4H,2,13H2,1H3
InChIKey
WIANYBUSMPVMES-UHFFFAOYSA-N
Compound name
ethyl 3-amino-8-bromo-6-fluoroimidazo[1,2-a]pyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.9862 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.99348 155.7
[M+Na]+ 323.97542 170.4
[M-H]- 299.97892 160.0
[M+NH4]+ 319.02002 175.0
[M+K]+ 339.94936 158.5
[M+H-H2O]+ 283.98346 153.7
[M+HCOO]- 345.98440 175.9
[M+CH3COO]- 360.00005 201.1
[M+Na-2H]- 321.96087 160.7
[M]+ 300.98565 176.5
[M]- 300.98675 176.5
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.