CID 105292

66142-21-0

Structural Information

Molecular Formula

C₁₇H₁₅O₃

SMILES

COC1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C(=C2)OC

InChI

InChI=1S/C17H15O3/c1-18-13-9-7-12(8-10-13)16-11-17(19-2)14-5-3-4-6-15(14)20-16/h3-11H,1-2H3/q+1

InChIKey

NPRZULDMOSEXEK-UHFFFAOYSA-N

Compound name

4-methoxy-2-(4-methoxyphenyl)chromenylium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 267.1021 Da
Monoisotopic Mass: None
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]+	268.10938	162.7
[M+Na]+	290.09132	171.8
[M-H]-	266.09482	171.8
[M+NH4]+	285.13592	178.7
[M+K]+	306.06526	163.9
[M+H-H2O]+	250.09936	157.2
[M+HCOO]-	312.10030	185.0
[M+CH3COO]-	326.11595	191.8
[M+Na-2H]-	288.07677	172.7
[M]+	267.10155	166.2
[M]-	267.10265	166.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe