CID 150357456

4-azido-2-bromopyridine

Structural Information

Molecular Formula
C5H3BrN4
SMILES
C1=CN=C(C=C1N=[N+]=[N-])Br
InChI
InChI=1S/C5H3BrN4/c6-5-3-4(9-10-7)1-2-8-5/h1-3H
InChIKey
GVAMBUQREHIPLF-UHFFFAOYSA-N
Compound name
4-azido-2-bromopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.95412 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.961396 127.8
[M+Na]+ 220.943338 139.5
[M-H]- 196.946844 135.7
[M+NH4]+ 215.987943 149.5
[M+K]+ 236.917278 125.0
[M+H-H2O]+ 180.951380 130.2
[M+HCOO]- 242.952321 156.2
[M+CH3COO]- 256.967971 183.6
[M+Na-2H]- 218.928786 141.7
[M]+ 197.95357142 144.5
[M]- 197.95466858 144.5
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

No patent data available for this compound.