CID 58136996

6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-amine

Structural Information

Molecular Formula
C7H5F3N4
SMILES
C1=CC2=NN=C(N2C=C1C(F)(F)F)N
InChI
InChI=1S/C7H5F3N4/c8-7(9,10)4-1-2-5-12-13-6(11)14(5)3-4/h1-3H,(H2,11,13)
InChIKey
FYYHQALGUZDERU-UHFFFAOYSA-N
Compound name
6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

202.04663 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.05391 136.3
[M+Na]+ 225.03585 148.8
[M-H]- 201.03935 133.9
[M+NH4]+ 220.08045 154.3
[M+K]+ 241.00979 144.6
[M+H-H2O]+ 185.04389 126.6
[M+HCOO]- 247.04483 155.3
[M+CH3COO]- 261.06048 185.0
[M+Na-2H]- 223.02130 144.1
[M]+ 202.04608 133.3
[M]- 202.04718 133.3
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