CID 3011437

N-(4-chloro-2-pyridyl)-2-hydroxy-5-methoxy-benzamide

Structural Information

Molecular Formula
C13H11ClN2O3
SMILES
COC1=CC(=C(C=C1)O)C(=O)NC2=NC=CC(=C2)Cl
InChI
InChI=1S/C13H11ClN2O3/c1-19-9-2-3-11(17)10(7-9)13(18)16-12-6-8(14)4-5-15-12/h2-7,17H,1H3,(H,15,16,18)
InChIKey
QJXZKDFTYOPFOF-UHFFFAOYSA-N
Compound name
N-(4-chloropyridin-2-yl)-2-hydroxy-5-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

278.0458 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.05308 158.4
[M+Na]+ 301.03502 167.5
[M-H]- 277.03852 163.1
[M+NH4]+ 296.07962 173.1
[M+K]+ 317.00896 162.7
[M+H-H2O]+ 261.04306 151.1
[M+HCOO]- 323.04400 176.6
[M+CH3COO]- 337.05965 196.9
[M+Na-2H]- 299.02047 163.2
[M]+ 278.04525 161.3
[M]- 278.04635 161.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.