CID 3016826

N-(4-(2,4-dichlorophenoxy)phenyl)formamide

Structural Information

Molecular Formula
C13H9Cl2NO2
SMILES
C1=CC(=CC=C1NC=O)OC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C13H9Cl2NO2/c14-9-1-6-13(12(15)7-9)18-11-4-2-10(3-5-11)16-8-17/h1-8H,(H,16,17)
InChIKey
OTIPMCASPYRJGC-UHFFFAOYSA-N
Compound name
N-[4-(2,4-dichlorophenoxy)phenyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.00104 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.008316 157.3
[M+Na]+ 303.990258 167.6
[M-H]- 279.993764 163.8
[M+NH4]+ 299.034863 174.5
[M+K]+ 319.964198 161.3
[M+H-H2O]+ 263.998300 151.5
[M+HCOO]- 325.999241 173.9
[M+CH3COO]- 340.014891 198.8
[M+Na-2H]- 301.975706 162.7
[M]+ 281.00049142 162.1
[M]- 281.00158858 162.1
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.