CID 3050100

65808-73-3

Structural Information

Molecular Formula
C24H20Cl2N2O3
SMILES
CN(C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl)C(=O)CNC(=O)CC3=CC=CC=C3
InChI
InChI=1S/C24H20Cl2N2O3/c1-28(23(30)15-27-22(29)13-16-7-3-2-4-8-16)21-12-11-17(25)14-19(21)24(31)18-9-5-6-10-20(18)26/h2-12,14H,13,15H2,1H3,(H,27,29)
InChIKey
LWAKHSWFKANAFQ-UHFFFAOYSA-N
Compound name
N-[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

454.08508 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 455.09236 205.9
[M+Na]+ 477.07430 211.5
[M-H]- 453.07780 215.7
[M+NH4]+ 472.11890 215.3
[M+K]+ 493.04824 205.5
[M+H-H2O]+ 437.08234 197.0
[M+HCOO]- 499.08328 219.4
[M+CH3COO]- 513.09893 236.8
[M+Na-2H]- 475.05975 204.6
[M]+ 454.08453 211.4
[M]- 454.08563 211.4
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

No patent data available for this compound.