CID 721478

Methyl 3-[(3,4,5-trimethoxybenzoyl)amino]benzoate

Structural Information

Molecular Formula
C18H19NO6
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC(=C2)C(=O)OC
InChI
InChI=1S/C18H19NO6/c1-22-14-9-12(10-15(23-2)16(14)24-3)17(20)19-13-7-5-6-11(8-13)18(21)25-4/h5-10H,1-4H3,(H,19,20)
InChIKey
XIVFYJKKUAPOMV-UHFFFAOYSA-N
Compound name
methyl 3-[(3,4,5-trimethoxybenzoyl)amino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.12125 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.12853 179.0
[M+Na]+ 368.11047 190.8
[M+NH4]+ 363.15507 184.1
[M+K]+ 384.08441 186.0
[M-H]- 344.11397 181.4
[M+Na-2H]- 366.09592 184.8
[M]+ 345.12070 181.1
[M]- 345.12180 181.1
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.