CID 817106

3,4-dibromopyridine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

185
Patents

234.86322 Da
Monoisotopic Mass

2.2
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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.