CID 83382723

3-bromo-8-chloroimidazo[1,5-a]pyrazine

Structural Information

Molecular Formula
C6H3BrClN3
SMILES
C1=CN2C(=CN=C2Br)C(=N1)Cl
InChI
InChI=1S/C6H3BrClN3/c7-6-10-3-4-5(8)9-1-2-11(4)6/h1-3H
InChIKey
AYURINKSEQLEKG-UHFFFAOYSA-N
Compound name
3-bromo-8-chloroimidazo[1,5-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

230.91989 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.92717 140.2
[M+Na]+ 253.90911 146.4
[M+NH4]+ 248.95371 145.6
[M+K]+ 269.88305 146.5
[M-H]- 229.91261 140.0
[M+Na-2H]- 251.89456 144.5
[M]+ 230.91934 140.1
[M]- 230.92044 140.1
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