CID 80583709

2-azido-3-bromopyridine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

197.95412 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.96140 127.8
[M+Na]+ 220.94334 139.5
[M-H]- 196.94684 135.7
[M+NH4]+ 215.98794 149.5
[M+K]+ 236.91728 125.0
[M+H-H2O]+ 180.95138 130.2
[M+HCOO]- 242.95232 156.2
[M+CH3COO]- 256.96797 183.6
[M+Na-2H]- 218.92879 141.7
[M]+ 197.95357 144.5
[M]- 197.95467 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

No literature data available for this compound.

Patent stripe

patents stripe