CID 25132245

6-fluoro-3-methyl-1h-pyrazolo[3,4-b]pyridine

Structural Information

Molecular Formula
C7H6FN3
SMILES
CC1=C2C=CC(=NC2=NN1)F
InChI
InChI=1S/C7H6FN3/c1-4-5-2-3-6(8)9-7(5)11-10-4/h2-3H,1H3,(H,9,10,11)
InChIKey
IZYSSCSXSQEXPY-UHFFFAOYSA-N
Compound name
6-fluoro-3-methyl-2H-pyrazolo[3,4-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

151.05458 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.061856 126.1
[M+Na]+ 174.043798 138.5
[M-H]- 150.047304 125.1
[M+NH4]+ 169.088403 146.1
[M+K]+ 190.017738 134.5
[M+H-H2O]+ 134.051840 118.3
[M+HCOO]- 196.052781 147.0
[M+CH3COO]- 210.068431 140.1
[M+Na-2H]- 172.029246 134.4
[M]+ 151.05403142 125.8
[M]- 151.05512858 125.8
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