CID 1378796

N-(5-chloro-2-methylphenyl)-2-iodobenzamide

Structural Information

Molecular Formula
C14H11ClINO
SMILES
CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC=CC=C2I
InChI
InChI=1S/C14H11ClINO/c1-9-6-7-10(15)8-13(9)17-14(18)11-4-2-3-5-12(11)16/h2-8H,1H3,(H,17,18)
InChIKey
NVWFABZEMVDTIR-UHFFFAOYSA-N
Compound name
N-(5-chloro-2-methylphenyl)-2-iodobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

370.9574 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.96468 166.4
[M+Na]+ 393.94662 168.2
[M-H]- 369.95012 165.9
[M+NH4]+ 388.99122 178.9
[M+K]+ 409.92056 168.6
[M+H-H2O]+ 353.95466 156.1
[M+HCOO]- 415.95560 181.3
[M+CH3COO]- 429.97125 205.7
[M+Na-2H]- 391.93207 158.5
[M]+ 370.95685 165.4
[M]- 370.95795 165.4
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.