CID 10065066

6,8-di-c-methylluteolin 7-methyl ether

Structural Information

Molecular Formula

C₁₈H₁₆O₆

SMILES

CC1=C(C2=C(C(=C1OC)C)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O

InChI

InChI=1S/C18H16O6/c1-8-16(22)15-13(21)7-14(10-4-5-11(19)12(20)6-10)24-18(15)9(2)17(8)23-3/h4-7,19-20,22H,1-3H3

InChIKey

QDEUSJBJDJYZOM-UHFFFAOYSA-N

Compound name

2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-6,8-dimethylchromen-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 328.0947 Da
Monoisotopic Mass: 3.4
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]+	329.101976	173.3
[M+Na]+	351.083918	184.9
[M-H]-	327.087424	179.8
[M+NH4]+	346.128523	186.0
[M+K]+	367.057858	182.1
[M+H-H2O]+	311.091960	165.9
[M+HCOO]-	373.092901	191.6
[M+CH3COO]-	387.108551	207.3
[M+Na-2H]-	349.069366	176.2
[M]+	328.09415142	178.9
[M]-	328.09524858	178.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.