CID 4621668

3-chloro-n-(2,4,6-trichlorophenyl)benzamide

Structural Information

Molecular Formula
C13H7Cl4NO
SMILES
C1=CC(=CC(=C1)Cl)C(=O)NC2=C(C=C(C=C2Cl)Cl)Cl
InChI
InChI=1S/C13H7Cl4NO/c14-8-3-1-2-7(4-8)13(19)18-12-10(16)5-9(15)6-11(12)17/h1-6H,(H,18,19)
InChIKey
UPEBJUAADISMKR-UHFFFAOYSA-N
Compound name
3-chloro-N-(2,4,6-trichlorophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.92816 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.93544 171.1
[M+Na]+ 355.91738 187.4
[M+NH4]+ 350.96198 179.8
[M+K]+ 371.89132 177.6
[M-H]- 331.92088 175.1
[M+Na-2H]- 353.90283 179.3
[M]+ 332.92761 175.8
[M]- 332.92871 175.8
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.