CID 820409

3-bromo-5-iodopyridine

Structural Information

Molecular Formula
C5H3BrIN
SMILES
C1=C(C=NC=C1I)Br
InChI
InChI=1S/C5H3BrIN/c6-4-1-5(7)3-8-2-4/h1-3H
InChIKey
AOOZLVWDZUPEHT-UHFFFAOYSA-N
Compound name
3-bromo-5-iodopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

411
Patents

282.84937 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.85665 130.5
[M+Na]+ 305.83859 136.5
[M-H]- 281.84209 129.2
[M+NH4]+ 300.88319 148.3
[M+K]+ 321.81253 132.2
[M+H-H2O]+ 265.84663 127.3
[M+HCOO]- 327.84757 147.6
[M+CH3COO]- 341.86322 185.4
[M+Na-2H]- 303.82404 129.4
[M]+ 282.84882 145.2
[M]- 282.84992 145.2
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