CID 90657995

2-hydroxyeriodictyol

Structural Information

Molecular Formula

C₁₅H₁₂O₇

SMILES

C1C(=O)C2=C(C=C(C=C2OC1(C3=CC(=C(C=C3)O)O)O)O)O

InChI

InChI=1S/C15H12O7/c16-8-4-11(19)14-12(20)6-15(21,22-13(14)5-8)7-1-2-9(17)10(18)3-7/h1-5,16-19,21H,6H2

InChIKey

WBHCYFXEVWJBEE-UHFFFAOYSA-N

Compound name

2-(3,4-dihydroxyphenyl)-2,5,7-trihydroxy-3H-chromen-4-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 24
Patents: 304.0583 Da
Monoisotopic Mass: 1.3
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]+	305.06558	164.6
[M+Na]+	327.04752	173.9
[M-H]-	303.05102	167.7
[M+NH4]+	322.09212	178.2
[M+K]+	343.02146	171.2
[M+H-H2O]+	287.05556	158.6
[M+HCOO]-	349.05650	178.3
[M+CH3COO]-	363.07215	194.2
[M+Na-2H]-	325.03297	169.5
[M]+	304.05775	164.1
[M]-	304.05885	164.1

Literature stripe

literature stripe

Patent stripe

patents stripe