CID 94920

2-chloro-n-(4-chlorophenyl)acetamide

Structural Information

Molecular Formula
C8H7Cl2NO
SMILES
C1=CC(=CC=C1NC(=O)CCl)Cl
InChI
InChI=1S/C8H7Cl2NO/c9-5-8(12)11-7-3-1-6(10)2-4-7/h1-4H,5H2,(H,11,12)
InChIKey
UDRCRMHFHHTVSN-UHFFFAOYSA-N
Compound name
2-chloro-N-(4-chlorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

264
Patents

202.99046 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.99774 137.9
[M+Na]+ 225.97968 151.8
[M+NH4]+ 221.02428 147.1
[M+K]+ 241.95362 144.2
[M-H]- 201.98318 140.5
[M+Na-2H]- 223.96513 145.6
[M]+ 202.98991 141.2
[M]- 202.99101 141.2
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

patents stripe