CID 1019218

N-(3,5-dimethylphenyl)-2-iodobenzamide

Structural Information

Molecular Formula
C15H14INO
SMILES
CC1=CC(=CC(=C1)NC(=O)C2=CC=CC=C2I)C
InChI
InChI=1S/C15H14INO/c1-10-7-11(2)9-12(8-10)17-15(18)13-5-3-4-6-14(13)16/h3-9H,1-2H3,(H,17,18)
InChIKey
LXZZLALCAJVBQX-UHFFFAOYSA-N
Compound name
N-(3,5-dimethylphenyl)-2-iodobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.01202 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.01930 166.1
[M+Na]+ 374.00124 166.7
[M-H]- 350.00474 165.7
[M+NH4]+ 369.04584 178.5
[M+K]+ 389.97518 168.7
[M+H-H2O]+ 334.00928 155.0
[M+HCOO]- 396.01022 184.9
[M+CH3COO]- 410.02587 205.1
[M+Na-2H]- 371.98669 158.0
[M]+ 351.01147 163.3
[M]- 351.01257 163.3
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.