CID 121556

Brn 2567435

Structural Information

Molecular Formula
C23H22O3
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)CC4=CC=C(C=C4)OCC(CO)O
InChI
InChI=1S/C23H22O3/c24-14-17(25)15-26-18-11-9-16(10-12-18)13-23-21-7-3-1-5-19(21)20-6-2-4-8-22(20)23/h1-12,17,23-25H,13-15H2
InChIKey
CJAPYPISQHPPNH-UHFFFAOYSA-N
Compound name
3-[4-(9H-fluoren-9-ylmethyl)phenoxy]propane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.1569 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.16418 183.2
[M+Na]+ 369.14612 189.5
[M-H]- 345.14962 188.9
[M+NH4]+ 364.19072 198.5
[M+K]+ 385.12006 183.2
[M+H-H2O]+ 329.15416 175.5
[M+HCOO]- 391.15510 201.1
[M+CH3COO]- 405.17075 193.0
[M+Na-2H]- 367.13157 185.5
[M]+ 346.15635 184.6
[M]- 346.15745 184.6
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

No patent data available for this compound.