CID 131492392

2091668-88-9

Structural Information

Molecular Formula
C9H8BrN3O2
SMILES
COC(=O)C1=CN2C(=NC(=C2N)Br)C=C1
InChI
InChI=1S/C9H8BrN3O2/c1-15-9(14)5-2-3-6-12-7(10)8(11)13(6)4-5/h2-4H,11H2,1H3
InChIKey
OKHQYVULIBZDIL-UHFFFAOYSA-N
Compound name
methyl 3-amino-2-bromoimidazo[1,2-a]pyridine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.97998 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.987256 147.5
[M+Na]+ 291.969198 161.8
[M-H]- 267.972704 153.0
[M+NH4]+ 287.013803 167.9
[M+K]+ 307.943138 150.7
[M+H-H2O]+ 251.977240 146.5
[M+HCOO]- 313.978181 169.1
[M+CH3COO]- 327.993831 194.6
[M+Na-2H]- 289.954646 154.4
[M]+ 268.97943142 168.7
[M]- 268.98052858 168.7
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.