CID 82649

1-phenoxy-3-(4-phenoxyphenoxy)benzene

Structural Information

Molecular Formula
C24H18O3
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=CC=CC(=C3)OC4=CC=CC=C4
InChI
InChI=1S/C24H18O3/c1-3-8-19(9-4-1)25-21-14-16-22(17-15-21)27-24-13-7-12-23(18-24)26-20-10-5-2-6-11-20/h1-18H
InChIKey
GWXBGFIYQHKUSH-UHFFFAOYSA-N
Compound name
1-phenoxy-3-(4-phenoxyphenoxy)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

354.12558 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.13286 185.3
[M+Na]+ 377.11480 191.4
[M-H]- 353.11830 197.3
[M+NH4]+ 372.15940 196.5
[M+K]+ 393.08874 186.0
[M+H-H2O]+ 337.12284 173.8
[M+HCOO]- 399.12378 208.8
[M+CH3COO]- 413.13943 195.8
[M+Na-2H]- 375.10025 190.9
[M]+ 354.12503 186.6
[M]- 354.12613 186.6
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