CID 219124

1,2-bis(2-biphenylyloxy)ethane

Structural Information

Molecular Formula
C26H22O2
SMILES
C1=CC=C(C=C1)C2=CC=CC=C2OCCOC3=CC=CC=C3C4=CC=CC=C4
InChI
InChI=1S/C26H22O2/c1-3-11-21(12-4-1)23-15-7-9-17-25(23)27-19-20-28-26-18-10-8-16-24(26)22-13-5-2-6-14-22/h1-18H,19-20H2
InChIKey
RUTYZGCHBCCSKD-UHFFFAOYSA-N
Compound name
1-phenyl-2-[2-(2-phenylphenoxy)ethoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

366.162 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.169276 191.0
[M+Na]+ 389.151218 196.4
[M-H]- 365.154724 202.5
[M+NH4]+ 384.195823 201.8
[M+K]+ 405.125158 189.8
[M+H-H2O]+ 349.159260 179.3
[M+HCOO]- 411.160201 213.6
[M+CH3COO]- 425.175851 200.7
[M+Na-2H]- 387.136666 195.4
[M]+ 366.16145142 191.6
[M]- 366.16254858 191.6
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