CID 45050989

N-(4-chloro-2-methoxy-5-methylphenyl)-3-(3-chloro-4-methoxyphenyl)propanamide

Structural Information

Molecular Formula
C18H19Cl2NO3
SMILES
CC1=CC(=C(C=C1Cl)OC)NC(=O)CCC2=CC(=C(C=C2)OC)Cl
InChI
InChI=1S/C18H19Cl2NO3/c1-11-8-15(17(24-3)10-13(11)19)21-18(22)7-5-12-4-6-16(23-2)14(20)9-12/h4,6,8-10H,5,7H2,1-3H3,(H,21,22)
InChIKey
HLZREEBSJOSEAL-UHFFFAOYSA-N
Compound name
N-(4-chloro-2-methoxy-5-methylphenyl)-3-(3-chloro-4-methoxyphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.0742 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.08148 182.2
[M+Na]+ 390.06342 191.9
[M-H]- 366.06692 188.8
[M+NH4]+ 385.10802 196.6
[M+K]+ 406.03736 185.9
[M+H-H2O]+ 350.07146 176.0
[M+HCOO]- 412.07240 196.5
[M+CH3COO]- 426.08805 218.1
[M+Na-2H]- 388.04887 182.6
[M]+ 367.07365 190.5
[M]- 367.07475 190.5
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.