CID 311879

N,n'-bis-(2-(3,4-dimethoxy-phenyl)-ethyl)-oxalamide

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 200.1
[M+Na]+ 439.18395 204.2
[M-H]- 415.18745 206.4
[M+NH4]+ 434.22855 209.7
[M+K]+ 455.15789 202.8
[M+H-H2O]+ 399.19199 190.1
[M+HCOO]- 461.19293 223.2
[M+CH3COO]- 475.20858 231.7
[M+Na-2H]- 437.16940 199.9
[M]+ 416.19418 207.7
[M]- 416.19528 207.7
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.