CID 261394

7-fluoro-2-phenyl-4h-chromen-4-one

Structural Information

Molecular Formula
C15H9FO2
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)F
InChI
InChI=1S/C15H9FO2/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9H
InChIKey
ZEYRNYUCQATYPC-UHFFFAOYSA-N
Compound name
7-fluoro-2-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

8
Patents

240.05865 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.06593 148.4
[M+Na]+ 263.04787 159.4
[M-H]- 239.05137 156.4
[M+NH4]+ 258.09247 165.9
[M+K]+ 279.02181 155.7
[M+H-H2O]+ 223.05591 140.1
[M+HCOO]- 285.05685 170.9
[M+CH3COO]- 299.07250 162.4
[M+Na-2H]- 261.03332 157.1
[M]+ 240.05810 149.5
[M]- 240.05920 149.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe