CID 11573057

Schembl4806490

Structural Information

Molecular Formula
C14H10F2N4O2
SMILES
C1=CC(=C(C(=C1)F)F)CN2C=NC3=CC(=NC=C32)C(=O)NO
InChI
InChI=1S/C14H10F2N4O2/c15-9-3-1-2-8(13(9)16)6-20-7-18-10-4-11(14(21)19-22)17-5-12(10)20/h1-5,7,22H,6H2,(H,19,21)
InChIKey
IHWXEJBRSGUHOV-UHFFFAOYSA-N
Compound name
3-[(2,3-difluorophenyl)methyl]-N-hydroxyimidazo[4,5-c]pyridine-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

304.07718 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.08446 164.5
[M+Na]+ 327.06640 175.7
[M-H]- 303.06990 165.8
[M+NH4]+ 322.11100 177.5
[M+K]+ 343.04034 169.6
[M+H-H2O]+ 287.07444 153.7
[M+HCOO]- 349.07538 183.8
[M+CH3COO]- 363.09103 175.5
[M+Na-2H]- 325.05185 168.8
[M]+ 304.07663 164.6
[M]- 304.07773 164.6
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

patents stripe