CID 720820

2-amino-n-(2-chlorophenyl)benzamide

Structural Information

Molecular Formula
C13H11ClN2O
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=CC=C2Cl)N
InChI
InChI=1S/C13H11ClN2O/c14-10-6-2-4-8-12(10)16-13(17)9-5-1-3-7-11(9)15/h1-8H,15H2,(H,16,17)
InChIKey
WFSUBNNPXUDKAD-UHFFFAOYSA-N
Compound name
2-amino-N-(2-chlorophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

246.05598 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.06326 153.5
[M+Na]+ 269.04520 161.6
[M-H]- 245.04870 160.0
[M+NH4]+ 264.08980 170.8
[M+K]+ 285.01914 156.1
[M+H-H2O]+ 229.05324 146.9
[M+HCOO]- 291.05418 174.5
[M+CH3COO]- 305.06983 195.7
[M+Na-2H]- 267.03065 158.5
[M]+ 246.05543 152.9
[M]- 246.05653 152.9
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

patents stripe