CID 76847169

1256793-74-4

Structural Information

Molecular Formula
C7H4F3N3
SMILES
C1=C2C=NNC2=C(C=N1)C(F)(F)F
InChI
InChI=1S/C7H4F3N3/c8-7(9,10)5-3-11-1-4-2-12-13-6(4)5/h1-3H,(H,12,13)
InChIKey
FXGYCCBUSFVGSN-UHFFFAOYSA-N
Compound name
7-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.03574 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.04302 134.8
[M+Na]+ 210.02496 144.9
[M+NH4]+ 205.06956 140.3
[M+K]+ 225.99890 141.9
[M-H]- 186.02846 130.4
[M+Na-2H]- 208.01041 139.5
[M]+ 187.03519 134.7
[M]- 187.03629 134.7
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.