CID 983214

N-(2-benzoylphenyl)-2-(4-chlorophenoxy)acetamide

Structural Information

Molecular Formula
C21H16ClNO3
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)COC3=CC=C(C=C3)Cl
InChI
InChI=1S/C21H16ClNO3/c22-16-10-12-17(13-11-16)26-14-20(24)23-19-9-5-4-8-18(19)21(25)15-6-2-1-3-7-15/h1-13H,14H2,(H,23,24)
InChIKey
AUIFSJWYEOKXMC-UHFFFAOYSA-N
Compound name
N-(2-benzoylphenyl)-2-(4-chlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.08188 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.089156 184.5
[M+Na]+ 388.071098 190.8
[M-H]- 364.074604 193.8
[M+NH4]+ 383.115703 196.5
[M+K]+ 404.045038 184.8
[M+H-H2O]+ 348.079140 175.4
[M+HCOO]- 410.080081 203.2
[M+CH3COO]- 424.095731 215.4
[M+Na-2H]- 386.056546 187.4
[M]+ 365.08133142 187.4
[M]- 365.08242858 187.4
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.