CID 135429427

Schembl4800062

Structural Information

Molecular Formula
C14H11FN4O2
SMILES
C1=CC(=CC=C1CN2C3=CN=C(C=C3C=N2)C(=O)NO)F
InChI
InChI=1S/C14H11FN4O2/c15-11-3-1-9(2-4-11)8-19-13-7-16-12(14(20)18-21)5-10(13)6-17-19/h1-7,21H,8H2,(H,18,20)
InChIKey
SLFKGDKUNJLFKS-UHFFFAOYSA-N
Compound name
1-[(4-fluorophenyl)methyl]-N-hydroxypyrazolo[3,4-c]pyridine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

286.0866 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.09388 161.3
[M+Na]+ 309.07582 171.6
[M-H]- 285.07932 163.6
[M+NH4]+ 304.12042 174.8
[M+K]+ 325.04976 166.0
[M+H-H2O]+ 269.08386 151.2
[M+HCOO]- 331.08480 181.7
[M+CH3COO]- 345.10045 172.6
[M+Na-2H]- 307.06127 167.0
[M]+ 286.08605 162.0
[M]- 286.08715 162.0
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