CID 14349486

5,6-dimethoxyflavone

Structural Information

Molecular Formula

C₁₇H₁₄O₄

SMILES

COC1=C(C2=C(C=C1)OC(=CC2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C17H14O4/c1-19-14-9-8-13-16(17(14)20-2)12(18)10-15(21-13)11-6-4-3-5-7-11/h3-10H,1-2H3

InChIKey

GHLJEZSMMHWXTR-UHFFFAOYSA-N

Compound name

5,6-dimethoxy-2-phenylchromen-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 282.0892 Da
Monoisotopic Mass: 3.1
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]+	283.09648	160.9
[M+Na]+	305.07842	178.3
[M+NH4]+	300.12302	169.7
[M+K]+	321.05236	170.3
[M-H]-	281.08192	167.5
[M+Na-2H]-	303.06387	170.1
[M]+	282.08865	165.6
[M]-	282.08975	165.6

Literature stripe

literature stripe

Patent stripe

patents stripe