CID 710678

N-(3-chloro-4-methylphenyl)biphenyl-4-carboxamide

Structural Information

Molecular Formula
C20H16ClNO
SMILES
CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Cl
InChI
InChI=1S/C20H16ClNO/c1-14-7-12-18(13-19(14)21)22-20(23)17-10-8-16(9-11-17)15-5-3-2-4-6-15/h2-13H,1H3,(H,22,23)
InChIKey
ZLQSGSUTJGKQSX-UHFFFAOYSA-N
Compound name
N-(3-chloro-4-methylphenyl)-4-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.09204 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.09932 175.2
[M+Na]+ 344.08126 183.3
[M-H]- 320.08476 184.9
[M+NH4]+ 339.12586 189.7
[M+K]+ 360.05520 176.1
[M+H-H2O]+ 304.08930 166.7
[M+HCOO]- 366.09024 194.6
[M+CH3COO]- 380.10589 186.6
[M+Na-2H]- 342.06671 178.9
[M]+ 321.09149 176.6
[M]- 321.09259 176.6
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

No patent data available for this compound.