CID 55281297

3-hydrazinyl-6-(trifluoromethyl)pyridazine

Structural Information

Molecular Formula
C5H5F3N4
SMILES
C1=CC(=NN=C1C(F)(F)F)NN
InChI
InChI=1S/C5H5F3N4/c6-5(7,8)3-1-2-4(10-9)12-11-3/h1-2H,9H2,(H,10,12)
InChIKey
VWNXPJXONRYKAJ-UHFFFAOYSA-N
Compound name
[6-(trifluoromethyl)pyridazin-3-yl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

178.04663 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.05391 131.0
[M+Na]+ 201.03585 140.1
[M-H]- 177.03935 128.2
[M+NH4]+ 196.08045 147.8
[M+K]+ 217.00979 137.4
[M+H-H2O]+ 161.04389 121.4
[M+HCOO]- 223.04483 150.9
[M+CH3COO]- 237.06048 182.8
[M+Na-2H]- 199.02130 139.3
[M]+ 178.04608 124.3
[M]- 178.04718 124.3
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