CID 103584273

2-azido-5-bromo-3-chloropyridine

Structural Information

Molecular Formula
C5H2BrClN4
SMILES
C1=C(C=NC(=C1Cl)N=[N+]=[N-])Br
InChI
InChI=1S/C5H2BrClN4/c6-3-1-4(7)5(9-2-3)10-11-8/h1-2H
InChIKey
YXFHXUGRIZLHQJ-UHFFFAOYSA-N
Compound name
2-azido-5-bromo-3-chloropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.91515 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.922426 135.8
[M+Na]+ 254.904368 148.9
[M-H]- 230.907874 143.4
[M+NH4]+ 249.948973 157.1
[M+K]+ 270.878308 132.5
[M+H-H2O]+ 214.912410 139.0
[M+HCOO]- 276.913351 159.6
[M+CH3COO]- 290.929001 188.2
[M+Na-2H]- 252.889816 148.2
[M]+ 231.91460142 154.4
[M]- 231.91569858 154.4
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.