CID 7973

2-bromopyridine

Structural Information

Molecular Formula
C5H4BrN
SMILES
C1=CC=NC(=C1)Br
InChI
InChI=1S/C5H4BrN/c6-5-3-1-2-4-7-5/h1-4H
InChIKey
IMRWILPUOVGIMU-UHFFFAOYSA-N
Compound name
2-bromopyridine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

31
References

29050
Patents

156.95271 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.95999 119.5
[M+Na]+ 179.94193 131.9
[M-H]- 155.94543 124.8
[M+NH4]+ 174.98653 142.7
[M+K]+ 195.91587 122.0
[M+H-H2O]+ 139.94997 120.1
[M+HCOO]- 201.95091 141.7
[M+CH3COO]- 215.96656 173.3
[M+Na-2H]- 177.92738 131.1
[M]+ 156.95216 137.3
[M]- 156.95326 137.3
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