CID 11790

Alpha-naphthoflavone

Structural Information

Molecular Formula
C19H12O2
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C4=CC=CC=C4C=C3
InChI
InChI=1S/C19H12O2/c20-17-12-18(14-7-2-1-3-8-14)21-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12H
InChIKey
VFMMPHCGEFXGIP-UHFFFAOYSA-N
Compound name
2-phenylbenzo[h]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1005
References

2883
Patents

272.08374 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.09102 158.8
[M+Na]+ 295.07296 179.3
[M+NH4]+ 290.11756 169.8
[M+K]+ 311.04690 168.7
[M-H]- 271.07646 167.7
[M+Na-2H]- 293.05841 170.8
[M]+ 272.08319 164.8
[M]- 272.08429 164.8
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