CID 81759

Chlorodioctylaluminium

Structural Information

Molecular Formula
C16H34AlCl
SMILES
CCCCCCCC[Al](CCCCCCCC)Cl
InChI
InChI=1S/2C8H17.Al.ClH/c2*1-3-5-7-8-6-4-2;;/h2*1,3-8H2,2H3;;1H/q;;+1;/p-1
InChIKey
QRQUTSPLBBZERR-UHFFFAOYSA-M
Compound name
chloro(dioctyl)alumane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1587
Patents

288.21643 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.22371 177.1
[M+Na]+ 311.20565 180.3
[M-H]- 287.20915 175.2
[M+NH4]+ 306.25025 194.4
[M+K]+ 327.17959 175.3
[M+H-H2O]+ 271.21369 171.5
[M+HCOO]- 333.21463 191.6
[M+CH3COO]- 347.23028 205.2
[M+Na-2H]- 309.19110 176.4
[M]+ 288.21588 183.7
[M]- 288.21698 183.7
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

patents stripe