CID 817104

2,4-dibromopyridine

Structural Information

Molecular Formula
C5H3Br2N
SMILES
C1=CN=C(C=C1Br)Br
InChI
InChI=1S/C5H3Br2N/c6-4-1-2-8-5(7)3-4/h1-3H
InChIKey
PCMMSLVJMKQWMQ-UHFFFAOYSA-N
Compound name
2,4-dibromopyridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

985
Patents

234.86322 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.87050 122.3
[M+Na]+ 257.85244 134.5
[M-H]- 233.85594 128.6
[M+NH4]+ 252.89704 142.8
[M+K]+ 273.82638 119.9
[M+H-H2O]+ 217.86048 131.2
[M+HCOO]- 279.86142 139.3
[M+CH3COO]- 293.87707 193.8
[M+Na-2H]- 255.83789 132.7
[M]+ 234.86267 156.1
[M]- 234.86377 156.1
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