CID 6481036

5-fluoro-2-hydroxy-n-pyrazin-2-yl-benzamide

Structural Information

Molecular Formula
C11H8FN3O2
SMILES
C1=CC(=C(C=C1F)C(=O)NC2=NC=CN=C2)O
InChI
InChI=1S/C11H8FN3O2/c12-7-1-2-9(16)8(5-7)11(17)15-10-6-13-3-4-14-10/h1-6,16H,(H,14,15,17)
InChIKey
ZMKQLECINVQUNF-UHFFFAOYSA-N
Compound name
5-fluoro-2-hydroxy-N-pyrazin-2-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

233.06006 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.06734 148.0
[M+Na]+ 256.04928 156.5
[M-H]- 232.05278 150.0
[M+NH4]+ 251.09388 162.0
[M+K]+ 272.02322 152.4
[M+H-H2O]+ 216.05732 138.5
[M+HCOO]- 278.05826 168.9
[M+CH3COO]- 292.07391 189.2
[M+Na-2H]- 254.03473 154.6
[M]+ 233.05951 145.6
[M]- 233.06061 145.6
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

No patent data available for this compound.