CID 82529937

7-bromoimidazo[1,2-a]pyridine-2-carbonitrile

Structural Information

Molecular Formula
C8H4BrN3
SMILES
C1=CN2C=C(N=C2C=C1Br)C#N
InChI
InChI=1S/C8H4BrN3/c9-6-1-2-12-5-7(4-10)11-8(12)3-6/h1-3,5H
InChIKey
IRNDAJAYWYYKGS-UHFFFAOYSA-N
Compound name
7-bromoimidazo[1,2-a]pyridine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

220.95886 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.96614 142.9
[M+Na]+ 243.94808 148.2
[M+NH4]+ 238.99268 145.4
[M+K]+ 259.92202 145.3
[M-H]- 219.95158 136.9
[M+Na-2H]- 241.93353 144.7
[M]+ 220.95831 140.2
[M]- 220.95941 140.2
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