CID 83530

Aluminum, dichlorohexyl-

Structural Information

Molecular Formula
C6H13AlCl2
SMILES
CCCCCC[Al](Cl)Cl
InChI
InChI=1S/C6H13.Al.2ClH/c1-3-5-6-4-2;;;/h1,3-6H2,2H3;;2*1H/q;+2;;/p-2
InChIKey
VMLUVDHAXSZZSR-UHFFFAOYSA-L
Compound name
dichloro(hexyl)alumane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1686
Patents

182.02097 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.02825 136.1
[M+Na]+ 205.01019 143.8
[M-H]- 181.01369 135.3
[M+NH4]+ 200.05479 157.9
[M+K]+ 220.98413 139.8
[M+H-H2O]+ 165.01823 133.3
[M+HCOO]- 227.01917 148.9
[M+CH3COO]- 241.03482 180.1
[M+Na-2H]- 202.99564 140.2
[M]+ 182.02042 139.6
[M]- 182.02152 139.6
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.