CID 116984678

Ethyl 1-bromo-5h,6h,7h,8h-imidazo[1,5-a]pyridine-3-carboxylate

Structural Information

Molecular Formula
C10H13BrN2O2
SMILES
CCOC(=O)C1=NC(=C2N1CCCC2)Br
InChI
InChI=1S/C10H13BrN2O2/c1-2-15-10(14)9-12-8(11)7-5-3-4-6-13(7)9/h2-6H2,1H3
InChIKey
GQGNMPYVLIHLOQ-UHFFFAOYSA-N
Compound name
ethyl 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

272.01605 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.02333 156.5
[M+Na]+ 295.00527 157.9
[M+NH4]+ 290.04987 160.3
[M+K]+ 310.97921 159.8
[M-H]- 271.00877 155.1
[M+Na-2H]- 292.99072 156.5
[M]+ 272.01550 154.8
[M]- 272.01660 154.8
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

patents stripe