CID 30116

Butyl diselenide

Structural Information

Molecular Formula

C₈H₁₈Se₂

SMILES

CCCC[Se][Se]CCCC

InChI

InChI=1S/C8H18Se2/c1-3-5-7-9-10-8-6-4-2/h3-8H2,1-2H3

InChIKey

ARWXFTYBPFRIBM-UHFFFAOYSA-N

Compound name

1-(butyldiselanyl)butane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 273.97388 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]+	274.98116	161.7
[M+Na]+	296.96310	166.4
[M-H]-	272.96660	160.3
[M+NH4]+	292.00770	182.4
[M+K]+	312.93704	164.6
[M+H-H2O]+	256.97114	155.5
[M+HCOO]-	318.97208	182.8
[M+CH3COO]-	332.98773	184.2
[M+Na-2H]-	294.94855	164.2
[M]+	273.97333	164.7
[M]-	273.97443	164.7

Literature stripe

literature stripe

Patent stripe

patents stripe