CID 3011444

5-chloro-2-hydroxy-n-pyridin-2-ylbenzamide

Structural Information

Molecular Formula
C12H9ClN2O2
SMILES
C1=CC=NC(=C1)NC(=O)C2=C(C=CC(=C2)Cl)O
InChI
InChI=1S/C12H9ClN2O2/c13-8-4-5-10(16)9(7-8)12(17)15-11-3-1-2-6-14-11/h1-7,16H,(H,14,15,17)
InChIKey
JAFNHZDBCVSXTO-UHFFFAOYSA-N
Compound name
5-chloro-2-hydroxy-N-pyridin-2-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

248.03525 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.04253 151.0
[M+Na]+ 271.02447 159.8
[M-H]- 247.02797 155.5
[M+NH4]+ 266.06907 166.8
[M+K]+ 286.99841 154.5
[M+H-H2O]+ 231.03251 144.0
[M+HCOO]- 293.03345 169.4
[M+CH3COO]- 307.04910 190.5
[M+Na-2H]- 269.00992 157.1
[M]+ 248.03470 151.8
[M]- 248.03580 151.8
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

No patent data available for this compound.