CID 6447501

2-propenamide, n-(2-(3,4-dimethoxyphenyl)ethyl)-3-(4-methoxyphenyl)-2-methyl-

Structural Information

Molecular Formula
C21H25NO4
SMILES
C/C(=C\C1=CC=C(C=C1)OC)/C(=O)NCCC2=CC(=C(C=C2)OC)OC
InChI
InChI=1S/C21H25NO4/c1-15(13-16-5-8-18(24-2)9-6-16)21(23)22-12-11-17-7-10-19(25-3)20(14-17)26-4/h5-10,13-14H,11-12H2,1-4H3,(H,22,23)/b15-13+
InChIKey
JDRVKQMWEBWPJU-FYWRMAATSA-N
Compound name
(E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methoxyphenyl)-2-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.17834 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.185616 186.7
[M+Na]+ 378.167558 191.8
[M-H]- 354.171064 193.0
[M+NH4]+ 373.212163 199.2
[M+K]+ 394.141498 188.7
[M+H-H2O]+ 338.175600 177.7
[M+HCOO]- 400.176541 208.9
[M+CH3COO]- 414.192191 218.4
[M+Na-2H]- 376.153006 186.9
[M]+ 355.17779142 191.5
[M]- 355.17888858 191.5
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.