CID 6448152

82885-70-9

Structural Information

Molecular Formula
C23H24O6
SMILES
CCOC(=O)/C=C/C1=CC(=CC=C1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C23H24O6/c1-5-29-22(25)12-10-16-7-6-8-18(13-16)19(24)11-9-17-14-20(26-2)23(28-4)21(15-17)27-3/h6-15H,5H2,1-4H3/b11-9+,12-10+
InChIKey
NUSYSERTNLKKKP-WGDLNXRISA-N
Compound name
ethyl (E)-3-[3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]phenyl]prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.1573 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.164576 193.5
[M+Na]+ 419.146518 199.9
[M-H]- 395.150024 199.9
[M+NH4]+ 414.191123 204.6
[M+K]+ 435.120458 196.7
[M+H-H2O]+ 379.154560 184.4
[M+HCOO]- 441.155501 214.7
[M+CH3COO]- 455.171151 222.6
[M+Na-2H]- 417.131966 191.9
[M]+ 396.15675142 201.6
[M]- 396.15784858 201.6
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.