CID 6435256

Cinnamic acid, 4-methoxy-alpha-(p-methoxyphenyl)-, 2-(dimethylamino)ethyl ester, hydrochloride, e-

Structural Information

Molecular Formula
C21H25NO4
SMILES
CN(C)CCOC(=O)/C(=C/C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)OC
InChI
InChI=1S/C21H25NO4/c1-22(2)13-14-26-21(23)20(17-7-11-19(25-4)12-8-17)15-16-5-9-18(24-3)10-6-16/h5-12,15H,13-14H2,1-4H3/b20-15+
InChIKey
NHUODTIANNFIAD-HMMYKYKNSA-N
Compound name
2-(dimethylamino)ethyl (E)-2,3-bis(4-methoxyphenyl)prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.17834 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.185616 186.9
[M+Na]+ 378.167558 191.3
[M-H]- 354.171064 194.2
[M+NH4]+ 373.212163 199.7
[M+K]+ 394.141498 189.5
[M+H-H2O]+ 338.175600 177.5
[M+HCOO]- 400.176541 209.6
[M+CH3COO]- 414.192191 220.5
[M+Na-2H]- 376.153006 187.0
[M]+ 355.17779142 192.6
[M]- 355.17888858 192.6
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.