CID 1628359

4-(2,4-dichlorophenoxy)-n-(2-methylphenyl)butanamide

Structural Information

Molecular Formula
C17H17Cl2NO2
SMILES
CC1=CC=CC=C1NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C17H17Cl2NO2/c1-12-5-2-3-6-15(12)20-17(21)7-4-10-22-16-9-8-13(18)11-14(16)19/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,20,21)
InChIKey
UMRPVSWJXSKSRJ-UHFFFAOYSA-N
Compound name
4-(2,4-dichlorophenoxy)-N-(2-methylphenyl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.06363 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.07091 176.1
[M+Na]+ 360.05285 191.4
[M+NH4]+ 355.09745 184.5
[M+K]+ 376.02679 182.0
[M-H]- 336.05635 180.9
[M+Na-2H]- 358.03830 184.5
[M]+ 337.06308 180.4
[M]- 337.06418 180.4
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.