CID 2761038

5-bromo-2-hydrazinylpyrimidine

Structural Information

Molecular Formula
C4H5BrN4
SMILES
C1=C(C=NC(=N1)NN)Br
InChI
InChI=1S/C4H5BrN4/c5-3-1-7-4(9-6)8-2-3/h1-2H,6H2,(H,7,8,9)
InChIKey
JUOYVELUZXXEGE-UHFFFAOYSA-N
Compound name
(5-bromopyrimidin-2-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

84
Patents

187.96976 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.97704 125.5
[M+Na]+ 210.95898 137.2
[M-H]- 186.96248 129.2
[M+NH4]+ 206.00358 145.4
[M+K]+ 226.93292 126.1
[M+H-H2O]+ 170.96702 123.8
[M+HCOO]- 232.96796 148.0
[M+CH3COO]- 246.98361 182.4
[M+Na-2H]- 208.94443 136.4
[M]+ 187.96921 141.2
[M]- 187.97031 141.2
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