CID 87831879

Dmsep

Structural Information

Molecular Formula

C₅H₁₁O₂Se

SMILES

C[Se+](C)CCC(=O)O

InChI

InChI=1S/C5H10O2Se/c1-8(2)4-3-5(6)7/h3-4H2,1-2H3/p+1

InChIKey

DBCGWLLKQUWQLH-UHFFFAOYSA-O

Compound name

2-carboxyethyl(dimethyl)selanium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 0
Patents: 182.99243 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]+	183.99971	132.1
[M+Na]+	205.98165	143.5
[M+NH4]+	201.02625	140.5
[M+K]+	221.95559	139.5
[M-H]-	181.98515	132.2
[M+Na-2H]-	203.96710	135.4
[M]+	182.99188	133.8
[M]-	182.99298	133.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.