CID 16684155

68900-83-4

Structural Information

Molecular Formula

C₁₁H₂₃Al

SMILES

CCC/C=C/[Al](CCC)CCC

InChI

InChI=1S/C5H9.2C3H7.Al/c1-3-5-4-2;2*1-3-2;/h1,3H,4-5H2,2H3;2*1,3H2,2H3;

InChIKey

KWBNSIPWTCSVDI-UHFFFAOYSA-N

Compound name

[(E)-pent-1-enyl]-dipropylalumane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2
Patents: 182.16151 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]+	183.168786	146.8
[M+Na]+	205.150728	151.6
[M-H]-	181.154234	146.1
[M+NH4]+	200.195333	167.6
[M+K]+	221.124668	149.8
[M+H-H2O]+	165.158770	141.6
[M+HCOO]-	227.159711	167.8
[M+CH3COO]-	241.175361	184.9
[M+Na-2H]-	203.136176	149.4
[M]+	182.16096142	148.9
[M]-	182.16205858	148.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe