CID 75530544

6-trifluoromethylsulfanyl-pyridazin-3-ylamine

Structural Information

Molecular Formula
C5H4F3N3S
SMILES
C1=CC(=NN=C1N)SC(F)(F)F
InChI
InChI=1S/C5H4F3N3S/c6-5(7,8)12-4-2-1-3(9)10-11-4/h1-2H,(H2,9,10)
InChIKey
MJNSWCCOBRJAJK-UHFFFAOYSA-N
Compound name
6-(trifluoromethylsulfanyl)pyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.0078 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.01508 136.0
[M+Na]+ 217.99702 144.5
[M+NH4]+ 213.04162 141.6
[M+K]+ 233.97096 138.7
[M-H]- 194.00052 132.8
[M+Na-2H]- 215.98247 140.2
[M]+ 195.00725 136.4
[M]- 195.00835 136.4
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.