CID 137943661

2287288-20-2

Structural Information

Molecular Formula
C8H7F3N4
SMILES
CN1C2=C(C=N1)N=C(C(=C2)N)C(F)(F)F
InChI
InChI=1S/C8H7F3N4/c1-15-6-2-4(12)7(8(9,10)11)14-5(6)3-13-15/h2-3H,12H2,1H3
InChIKey
KSECZOSXIXAOGZ-UHFFFAOYSA-N
Compound name
1-methyl-5-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.06229 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.06957 141.7
[M+Na]+ 239.05151 151.3
[M+NH4]+ 234.09611 146.7
[M+K]+ 255.02545 148.8
[M-H]- 215.05501 137.8
[M+Na-2H]- 237.03696 145.6
[M]+ 216.06174 141.6
[M]- 216.06284 141.6
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.