CID 693324

3-bromo-2-chloropyridine

Structural Information

Molecular Formula
C5H3BrClN
SMILES
C1=CC(=C(N=C1)Cl)Br
InChI
InChI=1S/C5H3BrClN/c6-4-2-1-3-8-5(4)7/h1-3H
InChIKey
HDYNIWBNWMFBDO-UHFFFAOYSA-N
Compound name
3-bromo-2-chloropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1505
Patents

190.91374 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.92102 126.9
[M+Na]+ 213.90296 132.9
[M+NH4]+ 208.94756 133.2
[M+K]+ 229.87690 131.5
[M-H]- 189.90646 128.0
[M+Na-2H]- 211.88841 132.7
[M]+ 190.91319 127.3
[M]- 190.91429 127.3
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