CID 24212646

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

Structural Information

Molecular Formula
C15H12Cl3NO2
SMILES
CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2Cl)Cl)Cl
InChI
InChI=1S/C15H12Cl3NO2/c1-9-2-4-11(5-3-9)19-14(20)8-21-15-12(17)6-10(16)7-13(15)18/h2-7H,8H2,1H3,(H,19,20)
InChIKey
MHHJHGNDXALPIQ-UHFFFAOYSA-N
Compound name
N-(4-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.99335 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.000626 171.8
[M+Na]+ 365.982568 181.8
[M-H]- 341.986074 177.1
[M+NH4]+ 361.027173 186.8
[M+K]+ 381.956508 175.1
[M+H-H2O]+ 325.990610 166.7
[M+HCOO]- 387.991551 181.4
[M+CH3COO]- 402.007201 210.7
[M+Na-2H]- 363.968016 173.3
[M]+ 342.99280142 177.4
[M]- 342.99389858 177.4
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.