CID 24212653

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

Structural Information

Molecular Formula
C14H9Cl3FNO2
SMILES
C1=CC=C(C(=C1)NC(=O)COC2=C(C=C(C=C2Cl)Cl)Cl)F
InChI
InChI=1S/C14H9Cl3FNO2/c15-8-5-9(16)14(10(17)6-8)21-7-13(20)19-12-4-2-1-3-11(12)18/h1-6H,7H2,(H,19,20)
InChIKey
PUTCCGLFTVTBNS-UHFFFAOYSA-N
Compound name
N-(2-fluorophenyl)-2-(2,4,6-trichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.9683 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.97558 168.8
[M+Na]+ 369.95752 179.3
[M-H]- 345.96102 172.9
[M+NH4]+ 365.00212 183.6
[M+K]+ 385.93146 172.3
[M+H-H2O]+ 329.96556 163.0
[M+HCOO]- 391.96650 177.7
[M+CH3COO]- 405.98215 210.4
[M+Na-2H]- 367.94297 170.4
[M]+ 346.96775 173.2
[M]- 346.96885 173.2
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.