CID 343582

Luvangetin

Structural Information

Molecular Formula

C₁₅H₁₄O₄

SMILES

CC1(C=CC2=C(O1)C(=C3C(=C2)C=CC(=O)O3)OC)C

InChI

InChI=1S/C15H14O4/c1-15(2)7-6-10-8-9-4-5-11(16)18-12(9)14(17-3)13(10)19-15/h4-8H,1-3H3

InChIKey

XYPWCJWXFYYGPA-UHFFFAOYSA-N

Compound name

10-methoxy-2,2-dimethylpyrano[3,2-g]chromen-8-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 5
Patents: 258.0892 Da
Monoisotopic Mass: 2.8
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]+	259.096476	153.5
[M+Na]+	281.078418	165.2
[M-H]-	257.081924	161.4
[M+NH4]+	276.123023	172.5
[M+K]+	297.052358	164.7
[M+H-H2O]+	241.086460	146.8
[M+HCOO]-	303.087401	173.3
[M+CH3COO]-	317.103051	167.7
[M+Na-2H]-	279.063866	163.7
[M]+	258.08865142	159.8
[M]-	258.08974858	159.8

Literature stripe

literature stripe

Patent stripe

patents stripe