CID 116473743

4-bromo-6-hydrazinylpyrimidine

Structural Information

Molecular Formula
C4H5BrN4
SMILES
C1=C(N=CN=C1Br)NN
InChI
InChI=1S/C4H5BrN4/c5-3-1-4(9-6)8-2-7-3/h1-2H,6H2,(H,7,8,9)
InChIKey
DETBLSFLSBWOKG-UHFFFAOYSA-N
Compound name
(6-bromopyrimidin-4-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.96976 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.977036 125.5
[M+Na]+ 210.958978 137.2
[M-H]- 186.962484 129.2
[M+NH4]+ 206.003583 145.4
[M+K]+ 226.932918 126.1
[M+H-H2O]+ 170.967020 123.8
[M+HCOO]- 232.967961 148.0
[M+CH3COO]- 246.983611 182.4
[M+Na-2H]- 208.944426 136.4
[M]+ 187.96921142 141.2
[M]- 187.97030858 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.