CID 5787505

Brn 3619300

Structural Information

Molecular Formula
C19H20O3
SMILES
CCOC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=CC=C2)OCC
InChI
InChI=1S/C19H20O3/c1-3-21-18-13-11-16(14-19(18)22-4-2)17(20)12-10-15-8-6-5-7-9-15/h5-14H,3-4H2,1-2H3/b12-10+
InChIKey
VGXDYWAJLBJIJX-ZRDIBKRKSA-N
Compound name
(E)-1-(3,4-diethoxyphenyl)-3-phenylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.14124 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.14852 170.9
[M+Na]+ 319.13046 185.0
[M+NH4]+ 314.17506 178.4
[M+K]+ 335.10440 176.6
[M-H]- 295.13396 174.8
[M+Na-2H]- 317.11591 179.0
[M]+ 296.14069 174.0
[M]- 296.14179 174.0
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.