CID 6447501

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

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]+ 356.18562 186.7
[M+Na]+ 378.16756 191.8
[M-H]- 354.17106 193.0
[M+NH4]+ 373.21216 199.2
[M+K]+ 394.14150 188.7
[M+H-H2O]+ 338.17560 177.7
[M+HCOO]- 400.17654 208.9
[M+CH3COO]- 414.19219 218.4
[M+Na-2H]- 376.15301 186.9
[M]+ 355.17779 191.5
[M]- 355.17889 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.