CID 23543

5,8-dimethoxy-2-methylchromone

Structural Information

Molecular Formula

C₁₂H₁₂O₄

SMILES

CC1=CC(=O)C2=C(C=CC(=C2O1)OC)OC

InChI

InChI=1S/C12H12O4/c1-7-6-8(13)11-9(14-2)4-5-10(15-3)12(11)16-7/h4-6H,1-3H3

InChIKey

UFCZYGOJPCRTPW-UHFFFAOYSA-N

Compound name

5,8-dimethoxy-2-methylchromen-4-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 5
Patents: 220.07356 Da
Monoisotopic Mass: 1.9
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]+	221.08084	143.0
[M+Na]+	243.06278	158.6
[M+NH4]+	238.10738	151.5
[M+K]+	259.03672	152.3
[M-H]-	219.06628	147.0
[M+Na-2H]-	241.04823	149.5
[M]+	220.07301	146.5
[M]-	220.07411	146.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe