CID 311879

N,n'-bis[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide

Structural Information

Molecular Formula
C22H28N2O6
SMILES
COC1=C(C=C(C=C1)CCNC(=O)C(=O)NCCC2=CC(=C(C=C2)OC)OC)OC
InChI
InChI=1S/C22H28N2O6/c1-27-17-7-5-15(13-19(17)29-3)9-11-23-21(25)22(26)24-12-10-16-6-8-18(28-2)20(14-16)30-4/h5-8,13-14H,9-12H2,1-4H3,(H,23,25)(H,24,26)
InChIKey
LQBVWONWJAYQLO-UHFFFAOYSA-N
Compound name
N,N'-bis[2-(3,4-dimethoxyphenyl)ethyl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

416.19473 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.20201 201.3
[M+Na]+ 439.18395 210.9
[M+NH4]+ 434.22855 205.1
[M+K]+ 455.15789 205.5
[M-H]- 415.18745 203.7
[M+Na-2H]- 437.16940 205.6
[M]+ 416.19418 202.9
[M]- 416.19528 202.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.