CID 2743148

2-(2,4-dichlorophenoxy)propanamide

Structural Information

Molecular Formula
C9H9Cl2NO2
SMILES
CC(C(=O)N)OC1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C9H9Cl2NO2/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H2,12,13)
InChIKey
PCWMWJKZXONNDD-UHFFFAOYSA-N
Compound name
2-(2,4-dichlorophenoxy)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

233.00104 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.008316 144.7
[M+Na]+ 255.990258 154.0
[M-H]- 231.993764 147.8
[M+NH4]+ 251.034863 163.7
[M+K]+ 271.964198 149.6
[M+H-H2O]+ 215.998300 141.0
[M+HCOO]- 277.999241 158.9
[M+CH3COO]- 292.014891 191.2
[M+Na-2H]- 253.975706 147.2
[M]+ 233.00049142 147.8
[M]- 233.00158858 147.8
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