CID 984601

N1,n3-bis(2,5-dimethoxyphenyl)-1,3-benzenedicarboxamide

Structural Information

Molecular Formula
C24H24N2O6
SMILES
COC1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)C(=O)NC3=C(C=CC(=C3)OC)OC
InChI
InChI=1S/C24H24N2O6/c1-29-17-8-10-21(31-3)19(13-17)25-23(27)15-6-5-7-16(12-15)24(28)26-20-14-18(30-2)9-11-22(20)32-4/h5-14H,1-4H3,(H,25,27)(H,26,28)
InChIKey
YVPWRKZEWVLEHJ-UHFFFAOYSA-N
Compound name
1-N,3-N-bis(2,5-dimethoxyphenyl)benzene-1,3-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

436.16342 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 437.170696 203.8
[M+Na]+ 459.152638 208.9
[M-H]- 435.156144 213.7
[M+NH4]+ 454.197243 212.1
[M+K]+ 475.126578 206.9
[M+H-H2O]+ 419.160680 192.6
[M+HCOO]- 481.161621 227.3
[M+CH3COO]- 495.177271 235.7
[M+Na-2H]- 457.138086 204.4
[M]+ 436.16287142 209.7
[M]- 436.16396858 209.7
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.