CID 229015

3'-hydroxyflavone

Structural Information

Molecular Formula

C₁₅H₁₀O₃

SMILES

C1=CC=C2C(=C1)C(=O)C=C(O2)C3=CC(=CC=C3)O

InChI

InChI=1S/C15H10O3/c16-11-5-3-4-10(8-11)15-9-13(17)12-6-1-2-7-14(12)18-15/h1-9,16H

InChIKey

ISZWRZGKEWQACU-UHFFFAOYSA-N

Compound name

2-(3-hydroxyphenyl)chromen-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 10
References: 2407
Patents: 238.06299 Da
Monoisotopic Mass: 3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	239.07027	149.2
[M+Na]+	261.05221	166.6
[M+NH4]+	256.09681	158.6
[M+K]+	277.02615	158.7
[M-H]-	237.05571	155.9
[M+Na-2H]-	259.03766	159.0
[M]+	238.06244	153.8
[M]-	238.06354	153.8

Literature stripe

literature stripe

Patent stripe

patents stripe