CID 1809681

N-(2,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide

Structural Information

Molecular Formula
C18H21NO6
SMILES
COC1=CC(=C(C=C1)OC)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C18H21NO6/c1-21-12-6-7-14(22-2)13(10-12)19-18(20)11-8-15(23-3)17(25-5)16(9-11)24-4/h6-10H,1-5H3,(H,19,20)
InChIKey
SIFBHIPNISTHHU-UHFFFAOYSA-N
Compound name
N-(2,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

347.1369 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.144176 178.6
[M+Na]+ 370.126118 186.3
[M-H]- 346.129624 186.0
[M+NH4]+ 365.170723 191.8
[M+K]+ 386.100058 185.6
[M+H-H2O]+ 330.134160 169.7
[M+HCOO]- 392.135101 202.9
[M+CH3COO]- 406.150751 217.0
[M+Na-2H]- 368.111566 180.4
[M]+ 347.13635142 187.5
[M]- 347.13744858 187.5
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.