CID 5361779

67210-69-9

Structural Information

Molecular Formula
C20H13NO3
SMILES
C1=CC=C(C=C1)C2=C(C(=O)OC3=C2C=CC(=C3)O)C4=CN=CC=C4
InChI
InChI=1S/C20H13NO3/c22-15-8-9-16-17(11-15)24-20(23)19(14-7-4-10-21-12-14)18(16)13-5-2-1-3-6-13/h1-12,22H
InChIKey
USXABZNQZQPEAX-UHFFFAOYSA-N
Compound name
7-hydroxy-4-phenyl-3-pyridin-3-ylchromen-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.08954 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.09682 172.5
[M+Na]+ 338.07876 191.9
[M+NH4]+ 333.12336 181.4
[M+K]+ 354.05270 182.7
[M-H]- 314.08226 181.1
[M+Na-2H]- 336.06421 184.1
[M]+ 315.08899 178.1
[M]- 315.09009 178.1
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.