CID 22031055

Ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate

Structural Information

Molecular Formula
C10H9BrN2O2
SMILES
CCOC(=O)C1=CN=C2N1C=C(C=C2)Br
InChI
InChI=1S/C10H9BrN2O2/c1-2-15-10(14)8-5-12-9-4-3-7(11)6-13(8)9/h3-6H,2H2,1H3
InChIKey
VMTDOHAWLUJHAI-UHFFFAOYSA-N
Compound name
ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

146
Patents

267.98474 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.992016 148.3
[M+Na]+ 290.973958 162.4
[M-H]- 266.977464 153.9
[M+NH4]+ 286.018563 169.1
[M+K]+ 306.947898 151.8
[M+H-H2O]+ 250.982000 147.7
[M+HCOO]- 312.982941 169.3
[M+CH3COO]- 326.998591 192.3
[M+Na-2H]- 288.959406 155.9
[M]+ 267.98419142 171.2
[M]- 267.98528858 171.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe