CID 113539

Phenol, 4,4'-(1-methylethylidene)bis-, 2-propenyl ether

Structural Information

Molecular Formula
C21H24O2
SMILES
CC(CC1=CC=C(C=C1)OCC=C)C2=CC=C(C=C2)OCC=C
InChI
InChI=1S/C21H24O2/c1-4-14-22-20-10-6-18(7-11-20)16-17(3)19-8-12-21(13-9-19)23-15-5-2/h4-13,17H,1-2,14-16H2,3H3
InChIKey
GFBSUEZHLXXVIO-UHFFFAOYSA-N
Compound name
1-prop-2-enoxy-4-[1-(4-prop-2-enoxyphenyl)propan-2-yl]benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

308.17764 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.184916 176.0
[M+Na]+ 331.166858 181.6
[M-H]- 307.170364 181.9
[M+NH4]+ 326.211463 190.6
[M+K]+ 347.140798 176.5
[M+H-H2O]+ 291.174900 167.5
[M+HCOO]- 353.175841 197.8
[M+CH3COO]- 367.191491 208.5
[M+Na-2H]- 329.152306 177.6
[M]+ 308.17709142 179.1
[M]- 308.17818858 179.1
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.