CID 7275265

N-(2,4-dimethoxyphenyl)-2-(2,4,6-trichlorophenoxy)acetamide

Structural Information

Molecular Formula
C16H14Cl3NO4
SMILES
COC1=CC(=C(C=C1)NC(=O)COC2=C(C=C(C=C2Cl)Cl)Cl)OC
InChI
InChI=1S/C16H14Cl3NO4/c1-22-10-3-4-13(14(7-10)23-2)20-15(21)8-24-16-11(18)5-9(17)6-12(16)19/h3-7H,8H2,1-2H3,(H,20,21)
InChIKey
MYGZQPIVYKQPSD-UHFFFAOYSA-N
Compound name
N-(2,4-dimethoxyphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.99884 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.00612 180.1
[M+Na]+ 411.98806 190.3
[M-H]- 387.99156 185.8
[M+NH4]+ 407.03266 193.6
[M+K]+ 427.96200 184.9
[M+H-H2O]+ 371.99610 174.9
[M+HCOO]- 433.99704 189.9
[M+CH3COO]- 448.01269 218.8
[M+Na-2H]- 409.97351 180.9
[M]+ 388.99829 189.3
[M]- 388.99939 189.3
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

No patent data available for this compound.