CID 20751938

164917-82-2

Structural Information

Molecular Formula
C26H21FO4
SMILES
CC(=C)C(=O)OC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC=C(C=C3)OC(=O)C(=C)C)F
InChI
InChI=1S/C26H21FO4/c1-16(2)25(28)30-21-10-5-18(6-11-21)20-9-14-23(24(27)15-20)19-7-12-22(13-8-19)31-26(29)17(3)4/h5-15H,1,3H2,2,4H3
InChIKey
QMZWQOSUOMNGCF-UHFFFAOYSA-N
Compound name
[4-[3-fluoro-4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]phenyl] 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

481
Patents

416.1424 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.14968 201.0
[M+Na]+ 439.13162 214.4
[M+NH4]+ 434.17622 206.0
[M+K]+ 455.10556 207.4
[M-H]- 415.13512 204.3
[M+Na-2H]- 437.11707 208.3
[M]+ 416.14185 203.7
[M]- 416.14295 203.7
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

patents stripe