CID 3050093

65808-66-4

Structural Information

Molecular Formula
C18H16Cl2N2O3
SMILES
CC(=O)NCC(=O)N(C)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C18H16Cl2N2O3/c1-11(23)21-10-17(24)22(2)16-8-7-12(19)9-14(16)18(25)13-5-3-4-6-15(13)20/h3-9H,10H2,1-2H3,(H,21,23)
InChIKey
KRGTXXYCEVSDEZ-UHFFFAOYSA-N
Compound name
2-acetamido-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

378.0538 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.06108 184.5
[M+Na]+ 401.04302 197.3
[M+NH4]+ 396.08762 191.0
[M+K]+ 417.01696 190.6
[M-H]- 377.04652 188.3
[M+Na-2H]- 399.02847 191.3
[M]+ 378.05325 187.8
[M]- 378.05435 187.8
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.