CID 109367

68426-05-1

Structural Information

Molecular Formula
C18H20O2
SMILES
COC(CC1=CC=CC=C1)OCC=CC2=CC=CC=C2
InChI
InChI=1S/C18H20O2/c1-19-18(15-17-11-6-3-7-12-17)20-14-8-13-16-9-4-2-5-10-16/h2-13,18H,14-15H2,1H3
InChIKey
DIBGDYHBYFMHED-UHFFFAOYSA-N
Compound name
3-(1-methoxy-2-phenylethoxy)prop-1-enylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.14633 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.15361 165.1
[M+Na]+ 291.13555 179.1
[M+NH4]+ 286.18015 173.7
[M+K]+ 307.10949 170.1
[M-H]- 267.13905 169.7
[M+Na-2H]- 289.12100 174.5
[M]+ 268.14578 168.5
[M]- 268.14688 168.5
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.