CID 4383420

477320-06-2

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]+ 335.115706 176.9
[M+Na]+ 357.097648 183.8
[M-H]- 333.101154 183.5
[M+NH4]+ 352.142253 191.0
[M+K]+ 373.071588 179.1
[M+H-H2O]+ 317.105690 169.1
[M+HCOO]- 379.106631 197.5
[M+CH3COO]- 393.122281 213.7
[M+Na-2H]- 355.083096 180.2
[M]+ 334.10788142 181.9
[M]- 334.10897858 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