CID 2342100

2-chloro-n-(3-iodophenyl)acetamide

Structural Information

Molecular Formula
C8H7ClINO
SMILES
C1=CC(=CC(=C1)I)NC(=O)CCl
InChI
InChI=1S/C8H7ClINO/c9-5-8(12)11-7-3-1-2-6(10)4-7/h1-4H,5H2,(H,11,12)
InChIKey
RTCFRHNFYYNTGR-UHFFFAOYSA-N
Compound name
2-chloro-N-(3-iodophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

294.9261 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.93338 146.2
[M+Na]+ 317.91532 151.4
[M+NH4]+ 312.95992 150.6
[M+K]+ 333.88926 147.8
[M-H]- 293.91882 142.5
[M+Na-2H]- 315.90077 140.7
[M]+ 294.92555 145.0
[M]- 294.92665 145.0
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

patents stripe