CID 984589

4-chloro-n-(2-iodophenyl)benzamide

Structural Information

Molecular Formula
C13H9ClINO
SMILES
C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)Cl)I
InChI
InChI=1S/C13H9ClINO/c14-10-7-5-9(6-8-10)13(17)16-12-4-2-1-3-11(12)15/h1-8H,(H,16,17)
InChIKey
HBDDEFUTPBIDLH-UHFFFAOYSA-N
Compound name
4-chloro-N-(2-iodophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

356.94174 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.94902 162.4
[M+Na]+ 379.93096 163.7
[M-H]- 355.93446 161.7
[M+NH4]+ 374.97556 175.1
[M+K]+ 395.90490 164.3
[M+H-H2O]+ 339.93900 152.1
[M+HCOO]- 401.93994 177.6
[M+CH3COO]- 415.95559 201.8
[M+Na-2H]- 377.91641 155.6
[M]+ 356.94119 160.7
[M]- 356.94229 160.7
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.