CID 93249

47758-37-2

Structural Information

Molecular Formula
C31H26O4
SMILES
C1C(O1)COC2=CC=C(C=C2)C3(C4=CC=CC=C4C5=CC=CC=C53)C6=CC=C(C=C6)OCC7CO7
InChI
InChI=1S/C31H26O4/c1-3-7-29-27(5-1)28-6-2-4-8-30(28)31(29,21-9-13-23(14-10-21)32-17-25-19-34-25)22-11-15-24(16-12-22)33-18-26-20-35-26/h1-16,25-26H,17-20H2
InChIKey
LCSAOPVSVLGDLE-UHFFFAOYSA-N
Compound name
2-[[4-[9-[4-(oxiran-2-ylmethoxy)phenyl]fluoren-9-yl]phenoxy]methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1836
Patents

462.1831 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 463.19038 190.0
[M+Na]+ 485.17232 208.6
[M+NH4]+ 480.21692 200.8
[M+K]+ 501.14626 202.2
[M-H]- 461.17582 212.9
[M+Na-2H]- 483.15777 204.9
[M]+ 462.18255 201.8
[M]- 462.18365 201.8
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