CID 6434370

Cinnamic acid, 2-cinnamamidoethyl ester

Structural Information

Molecular Formula
C20H19NO3
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NCCOC(=O)/C=C/C2=CC=CC=C2
InChI
InChI=1S/C20H19NO3/c22-19(13-11-17-7-3-1-4-8-17)21-15-16-24-20(23)14-12-18-9-5-2-6-10-18/h1-14H,15-16H2,(H,21,22)/b13-11+,14-12+
InChIKey
QMOVVLYBZSQZKG-PHEQNACWSA-N
Compound name
2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl (E)-3-phenylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.1365 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.14378 178.9
[M+Na]+ 344.12572 190.4
[M+NH4]+ 339.17032 184.9
[M+K]+ 360.09966 182.4
[M-H]- 320.12922 182.0
[M+Na-2H]- 342.11117 186.1
[M]+ 321.13595 181.1
[M]- 321.13705 181.1
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.