CID 15688

1779-25-5

Structural Information

Molecular Formula
C8H18AlCl
SMILES
CC(C)C[Al](CC(C)C)Cl
InChI
InChI=1S/2C4H9.Al.ClH/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;;1H/q;;+1;/p-1
InChIKey
HQMRIBYCTLBDAK-UHFFFAOYSA-M
Compound name
chloro-bis(2-methylpropyl)alumane
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

0
References

19833
Patents

176.09125 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.09853 139.6
[M+Na]+ 199.08047 145.7
[M-H]- 175.08397 139.5
[M+NH4]+ 194.12507 161.4
[M+K]+ 215.05441 143.9
[M+H-H2O]+ 159.08851 136.0
[M+HCOO]- 221.08945 154.9
[M+CH3COO]- 235.10510 183.0
[M+Na-2H]- 197.06592 141.0
[M]+ 176.09070 141.9
[M]- 176.09180 141.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe