CID 2361

Beta-naphthoflavone

Structural Information

Molecular Formula
C19H12O2
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43
InChI
InChI=1S/C19H12O2/c20-16-12-18(14-7-2-1-3-8-14)21-17-11-10-13-6-4-5-9-15(13)19(16)17/h1-12H
InChIKey
OUGIDAPQYNCXRA-UHFFFAOYSA-N
Compound name
3-phenylbenzo[f]chromen-1-one
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

1577
References

3068
Patents

272.08374 Da
Monoisotopic Mass

4.4
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