CID 3046200

Brn 2170413

Structural Information

Molecular Formula
C26H22O2
SMILES
C1=CC=C(C=C1)OC2=CC=CC(=C2)CCC3=CC(=CC=C3)OC4=CC=CC=C4
InChI
InChI=1S/C26H22O2/c1-3-11-23(12-4-1)27-25-15-7-9-21(19-25)17-18-22-10-8-16-26(20-22)28-24-13-5-2-6-14-24/h1-16,19-20H,17-18H2
InChIKey
COEWCOFLTSIVMO-UHFFFAOYSA-N
Compound name
1-phenoxy-3-[2-(3-phenoxyphenyl)ethyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

366.162 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.16928 192.8
[M+Na]+ 389.15122 211.9
[M+NH4]+ 384.19582 202.6
[M+K]+ 405.12516 199.6
[M-H]- 365.15472 203.3
[M+Na-2H]- 387.13667 207.9
[M]+ 366.16145 199.0
[M]- 366.16255 199.0
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