CID 51072264

1243250-18-1

Structural Information

Molecular Formula
C3H6BrN5
SMILES
CN1C(=NC(=N1)Br)NN
InChI
InChI=1S/C3H6BrN5/c1-9-3(7-5)6-2(4)8-9/h5H2,1H3,(H,6,7,8)
InChIKey
LNUUAIXKGVBAPO-UHFFFAOYSA-N
Compound name
(5-bromo-2-methyl-1,2,4-triazol-3-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.98067 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.98795 127.2
[M+Na]+ 213.96989 140.3
[M-H]- 189.97339 130.2
[M+NH4]+ 209.01449 147.8
[M+K]+ 229.94383 129.7
[M+H-H2O]+ 173.97793 125.0
[M+HCOO]- 235.97887 149.6
[M+CH3COO]- 249.99452 183.4
[M+Na-2H]- 211.95534 135.6
[M]+ 190.98012 144.0
[M]- 190.98122 144.0
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.