CID 3043662

55916-15-9

Structural Information

Molecular Formula
C15H9FO2
SMILES
C1=CC=C(C=C1)C2C(=O)C3=C(C2=O)C=C(C=C3)F
InChI
InChI=1S/C15H9FO2/c16-10-6-7-11-12(8-10)15(18)13(14(11)17)9-4-2-1-3-5-9/h1-8,13H
InChIKey
XBMADVPYRHESEM-UHFFFAOYSA-N
Compound name
5-fluoro-2-phenylindene-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.05865 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.06593 152.7
[M+Na]+ 263.04787 167.1
[M+NH4]+ 258.09247 161.7
[M+K]+ 279.02181 160.7
[M-H]- 239.05137 156.0
[M+Na-2H]- 261.03332 159.9
[M]+ 240.05810 155.7
[M]- 240.05920 155.7
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.