CID 36851

N-(5-chloropyridin-2-yl)-2-fluorobenzamide

Structural Information

Molecular Formula
C12H8ClFN2O
SMILES
C1=CC=C(C(=C1)C(=O)NC2=NC=C(C=C2)Cl)F
InChI
InChI=1S/C12H8ClFN2O/c13-8-5-6-11(15-7-8)16-12(17)9-3-1-2-4-10(9)14/h1-7H,(H,15,16,17)
InChIKey
REOUSSGUTFKMAI-UHFFFAOYSA-N
Compound name
N-(5-chloropyridin-2-yl)-2-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

250.03091 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.03819 150.6
[M+Na]+ 273.02013 165.2
[M+NH4]+ 268.06473 158.7
[M+K]+ 288.99407 157.5
[M-H]- 249.02363 153.7
[M+Na-2H]- 271.00558 160.0
[M]+ 250.03036 153.8
[M]- 250.03146 153.8
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.