CID 302980

N-(3-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide

Structural Information

Molecular Formula
C14H10Cl3NO2
SMILES
C1=CC(=CC(=C1)Cl)NC(=O)COC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H10Cl3NO2/c15-9-2-1-3-11(6-9)18-14(19)8-20-13-5-4-10(16)7-12(13)17/h1-7H,8H2,(H,18,19)
InChIKey
GRLOINLFWVWIIU-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

328.97772 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.98500 167.4
[M+Na]+ 351.96694 177.0
[M-H]- 327.97044 172.5
[M+NH4]+ 347.01154 182.7
[M+K]+ 367.94088 170.4
[M+H-H2O]+ 311.97498 162.3
[M+HCOO]- 373.97592 177.3
[M+CH3COO]- 387.99157 206.8
[M+Na-2H]- 349.95239 170.1
[M]+ 328.97717 172.3
[M]- 328.97827 172.3
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