CID 2389991

2-chloro-n-(5-chloro-2-cyanophenyl)acetamide

Structural Information

Molecular Formula
C9H6Cl2N2O
SMILES
C1=CC(=C(C=C1Cl)NC(=O)CCl)C#N
InChI
InChI=1S/C9H6Cl2N2O/c10-4-9(14)13-8-3-7(11)2-1-6(8)5-12/h1-3H,4H2,(H,13,14)
InChIKey
LIULOSOFIJGOCL-UHFFFAOYSA-N
Compound name
2-chloro-N-(5-chloro-2-cyanophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.98572 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.99300 143.1
[M+Na]+ 250.97494 155.9
[M+NH4]+ 246.01954 148.2
[M+K]+ 266.94888 146.0
[M-H]- 226.97844 138.3
[M+Na-2H]- 248.96039 147.4
[M]+ 227.98517 143.2
[M]- 227.98627 143.2
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

No patent data available for this compound.