CID 3055235

5-(p-chlorophenoxy)picolinamide

Structural Information

Molecular Formula
C12H9ClN2O2
SMILES
C1=CC(=CC=C1OC2=CN=C(C=C2)C(=O)N)Cl
InChI
InChI=1S/C12H9ClN2O2/c13-8-1-3-9(4-2-8)17-10-5-6-11(12(14)16)15-7-10/h1-7H,(H2,14,16)
InChIKey
GUJREVOWVMEPEX-UHFFFAOYSA-N
Compound name
5-(4-chlorophenoxy)pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

248.03525 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.04253 151.1
[M+Na]+ 271.02447 160.3
[M-H]- 247.02797 156.4
[M+NH4]+ 266.06907 167.2
[M+K]+ 286.99841 155.5
[M+H-H2O]+ 231.03251 143.8
[M+HCOO]- 293.03345 170.3
[M+CH3COO]- 307.04910 193.0
[M+Na-2H]- 269.00992 156.6
[M]+ 248.03470 152.8
[M]- 248.03580 152.8
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

patents stripe