CID 465669

2-[4-chloro-2-(phenylcarbonyl)phenoxy]-n-phenylacetamide

Structural Information

Molecular Formula
C21H16ClNO3
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)OCC(=O)NC3=CC=CC=C3
InChI
InChI=1S/C21H16ClNO3/c22-16-11-12-19(18(13-16)21(25)15-7-3-1-4-8-15)26-14-20(24)23-17-9-5-2-6-10-17/h1-13H,14H2,(H,23,24)
InChIKey
DTGVSZSMDOMAEB-UHFFFAOYSA-N
Compound name
2-(2-benzoyl-4-chlorophenoxy)-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
Patents

365.08188 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.08916 184.5
[M+Na]+ 388.07110 190.8
[M-H]- 364.07460 193.8
[M+NH4]+ 383.11570 196.5
[M+K]+ 404.04504 184.8
[M+H-H2O]+ 348.07914 175.4
[M+HCOO]- 410.08008 203.2
[M+CH3COO]- 424.09573 215.4
[M+Na-2H]- 386.05655 187.4
[M]+ 365.08133 187.4
[M]- 365.08243 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

literature stripe

Patent stripe

patents stripe