CID 2727258

129015-69-6

Structural Information

Molecular Formula
C6H5ClF3N3
SMILES
C1=C(C=NC(=C1C(F)(F)F)NN)Cl
InChI
InChI=1S/C6H5ClF3N3/c7-3-1-4(6(8,9)10)5(13-11)12-2-3/h1-2H,11H2,(H,12,13)
InChIKey
OYDFLZYOHRCSAV-UHFFFAOYSA-N
Compound name
[5-chloro-3-(trifluoromethyl)pyridin-2-yl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

20
Patents

211.0124 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.01968 136.8
[M+Na]+ 234.00162 147.0
[M-H]- 210.00512 135.3
[M+NH4]+ 229.04622 154.6
[M+K]+ 249.97556 142.3
[M+H-H2O]+ 194.00966 128.8
[M+HCOO]- 256.01060 153.1
[M+CH3COO]- 270.02625 188.0
[M+Na-2H]- 231.98707 143.1
[M]+ 211.01185 132.3
[M]- 211.01295 132.3
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