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]+ 356.18562 186.9
[M+Na]+ 378.16756 191.3
[M-H]- 354.17106 194.2
[M+NH4]+ 373.21216 199.7
[M+K]+ 394.14150 189.5
[M+H-H2O]+ 338.17560 177.5
[M+HCOO]- 400.17654 209.6
[M+CH3COO]- 414.19219 220.5
[M+Na-2H]- 376.15301 187.0
[M]+ 355.17779 192.6
[M]- 355.17889 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.