CID 1032601

3,4,5-trimethoxy-n-(4-phenoxyphenyl)benzamide

Structural Information

Molecular Formula
C22H21NO5
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3
InChI
InChI=1S/C22H21NO5/c1-25-19-13-15(14-20(26-2)21(19)27-3)22(24)23-16-9-11-18(12-10-16)28-17-7-5-4-6-8-17/h4-14H,1-3H3,(H,23,24)
InChIKey
PAOGGZSGIWSFFK-UHFFFAOYSA-N
Compound name
3,4,5-trimethoxy-N-(4-phenoxyphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.14197 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.14925 189.6
[M+Na]+ 402.13119 195.9
[M-H]- 378.13469 199.5
[M+NH4]+ 397.17579 200.6
[M+K]+ 418.10513 193.2
[M+H-H2O]+ 362.13923 179.0
[M+HCOO]- 424.14017 213.5
[M+CH3COO]- 438.15582 221.4
[M+Na-2H]- 400.11664 192.3
[M]+ 379.14142 195.1
[M]- 379.14252 195.1
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.