CID 755749

N-(3,4-dimethoxyphenyl)-3,4-dimethoxybenzamide

Structural Information

Molecular Formula
C17H19NO5
SMILES
COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)OC)OC
InChI
InChI=1S/C17H19NO5/c1-20-13-7-5-11(9-15(13)22-3)17(19)18-12-6-8-14(21-2)16(10-12)23-4/h5-10H,1-4H3,(H,18,19)
InChIKey
WYWWTTXHQDQGAX-UHFFFAOYSA-N
Compound name
N-(3,4-dimethoxyphenyl)-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

317.1263 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.133576 171.7
[M+Na]+ 340.115518 179.2
[M-H]- 316.119024 179.0
[M+NH4]+ 335.160123 186.0
[M+K]+ 356.089458 177.9
[M+H-H2O]+ 300.123560 163.1
[M+HCOO]- 362.124501 196.2
[M+CH3COO]- 376.140151 210.5
[M+Na-2H]- 338.100966 174.6
[M]+ 317.12575142 178.4
[M]- 317.12684858 178.4
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.