CID 4383420

N-(4-chlorophenyl)-2-[(2,4-dimethoxybenzyl)amino]acetamide

Structural Information

Molecular Formula
C17H19ClN2O3
SMILES
COC1=CC(=C(C=C1)CNCC(=O)NC2=CC=C(C=C2)Cl)OC
InChI
InChI=1S/C17H19ClN2O3/c1-22-15-8-3-12(16(9-15)23-2)10-19-11-17(21)20-14-6-4-13(18)5-7-14/h3-9,19H,10-11H2,1-2H3,(H,20,21)
InChIKey
SRNOHVKFJQSIJT-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)-2-[(2,4-dimethoxyphenyl)methylamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

334.10843 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.11571 176.9
[M+Na]+ 357.09765 183.8
[M-H]- 333.10115 183.5
[M+NH4]+ 352.14225 191.0
[M+K]+ 373.07159 179.1
[M+H-H2O]+ 317.10569 169.1
[M+HCOO]- 379.10663 197.5
[M+CH3COO]- 393.12228 213.7
[M+Na-2H]- 355.08310 180.2
[M]+ 334.10788 181.9
[M]- 334.10898 181.9
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

patents stripe