CID 96646

N-(4-chlorophenyl)benzamide

Structural Information

Molecular Formula
C13H10ClNO
SMILES
C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)Cl
InChI
InChI=1S/C13H10ClNO/c14-11-6-8-12(9-7-11)15-13(16)10-4-2-1-3-5-10/h1-9H,(H,15,16)
InChIKey
PJFPJLMLHHTWDZ-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

110
Patents

231.04509 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.05237 149.3
[M+Na]+ 254.03431 164.7
[M+NH4]+ 249.07891 159.0
[M+K]+ 270.00825 156.0
[M-H]- 230.03781 154.9
[M+Na-2H]- 252.01976 159.9
[M]+ 231.04454 153.5
[M]- 231.04564 153.5
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