CID 105454075

3-(trifluoromethyl)-1h-indazol-7-ol

Structural Information

Molecular Formula
C8H5F3N2O
SMILES
C1=CC2=C(NN=C2C(=C1)O)C(F)(F)F
InChI
InChI=1S/C8H5F3N2O/c9-8(10,11)7-4-2-1-3-5(14)6(4)12-13-7/h1-3,14H,(H,12,13)
InChIKey
MIICSPIRZYKKPD-UHFFFAOYSA-N
Compound name
3-(trifluoromethyl)-2H-indazol-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.0354 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.04268 139.7
[M+Na]+ 225.02462 149.3
[M+NH4]+ 220.06922 144.9
[M+K]+ 240.99856 146.6
[M-H]- 201.02812 135.1
[M+Na-2H]- 223.01007 143.3
[M]+ 202.03485 139.4
[M]- 202.03595 139.4
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.