CID 18952735

Di-n-octylaluminium iodide

Structural Information

Molecular Formula
C16H34Al
SMILES
CCCCCCCC[Al+]CCCCCCCC
InChI
InChI=1S/2C8H17.Al/c2*1-3-5-7-8-6-4-2;/h2*1,3-8H2,2H3;/q;;+1
InChIKey
TZUGKZMYHPFSAF-UHFFFAOYSA-N
Compound name
dioctylalumanylium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

775
Patents

253.24759 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.254866 171.6
[M+Na]+ 276.236808 174.4
[M-H]- 252.240314 170.1
[M+NH4]+ 271.281413 189.4
[M+K]+ 292.210748 166.1
[M+H-H2O]+ 236.244850 168.1
[M+HCOO]- 298.245791 191.5
[M+CH3COO]- 312.261441 194.5
[M+Na-2H]- 274.222256 174.8
[M]+ 253.24704142 175.9
[M]- 253.24813858 175.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.