CID 11140953

(e,e)-1,6-bis(4-methoxyphenyl)-1,5-hexadiene

Structural Information

Molecular Formula
C20H22O2
SMILES
COC1=CC=C(C=C1)/C=C/CC/C=C/C2=CC=C(C=C2)OC
InChI
InChI=1S/C20H22O2/c1-21-19-13-9-17(10-14-19)7-5-3-4-6-8-18-11-15-20(22-2)16-12-18/h5-16H,3-4H2,1-2H3/b7-5+,8-6+
InChIKey
FWOYMKXDIXNXIC-KQQUZDAGSA-N
Compound name
1-methoxy-4-[(1E,5E)-6-(4-methoxyphenyl)hexa-1,5-dienyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

294.162 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.16928 172.7
[M+Na]+ 317.15122 187.5
[M+NH4]+ 312.19582 180.8
[M+K]+ 333.12516 177.4
[M-H]- 293.15472 177.3
[M+Na-2H]- 315.13667 181.3
[M]+ 294.16145 176.2
[M]- 294.16255 176.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe