CID 3764404

117344-32-8

Structural Information

Molecular Formula
C29H26O4
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC=C(C=C4)OCCO)C5=CC=C(C=C5)OCCO
InChI
InChI=1S/C29H26O4/c30-17-19-32-23-13-9-21(10-14-23)29(22-11-15-24(16-12-22)33-20-18-31)27-7-3-1-5-25(27)26-6-2-4-8-28(26)29/h1-16,30-31H,17-20H2
InChIKey
NQXNYVAALXGLQT-UHFFFAOYSA-N
Compound name
2-[4-[9-[4-(2-hydroxyethoxy)phenyl]fluoren-9-yl]phenoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

5776
Patents

438.1831 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.19038 209.1
[M+Na]+ 461.17232 215.9
[M-H]- 437.17582 217.9
[M+NH4]+ 456.21692 222.1
[M+K]+ 477.14626 208.7
[M+H-H2O]+ 421.18036 198.8
[M+HCOO]- 483.18130 227.0
[M+CH3COO]- 497.19695 217.6
[M+Na-2H]- 459.15777 211.7
[M]+ 438.18255 212.2
[M]- 438.18365 212.2
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.