CID 3043669

55916-25-1

Structural Information

Molecular Formula
C19H11FO2
SMILES
C1=CC=C2C=C(C=CC2=C1)C3C(=O)C4=C(C3=O)C=C(C=C4)F
InChI
InChI=1S/C19H11FO2/c20-14-7-8-15-16(10-14)19(22)17(18(15)21)13-6-5-11-3-1-2-4-12(11)9-13/h1-10,17H
InChIKey
DIEGSOAYSCGRCE-UHFFFAOYSA-N
Compound name
5-fluoro-2-naphthalen-2-ylindene-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.0743 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.08158 163.9
[M+Na]+ 313.06352 175.1
[M-H]- 289.06702 172.1
[M+NH4]+ 308.10812 183.5
[M+K]+ 329.03746 168.4
[M+H-H2O]+ 273.07156 155.9
[M+HCOO]- 335.07250 185.1
[M+CH3COO]- 349.08815 176.9
[M+Na-2H]- 311.04897 167.2
[M]+ 290.07375 163.8
[M]- 290.07485 163.8
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

No patent data available for this compound.