CID 101908

917-65-7

Structural Information

Molecular Formula
CH3AlCl2
SMILES
C[Al](Cl)Cl
InChI
InChI=1S/CH3.Al.2ClH/h1H3;;2*1H/q;+2;;/p-2
InChIKey
YSTQWZZQKCCBAY-UHFFFAOYSA-L
Compound name
dichloro(methyl)alumane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

14010
Patents

111.94272 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.95000 112.5
[M+Na]+ 134.93194 122.1
[M-H]- 110.93544 112.6
[M+NH4]+ 129.97654 137.0
[M+K]+ 150.90588 119.6
[M+H-H2O]+ 94.939980 110.8
[M+HCOO]- 156.94092 126.9
[M+CH3COO]- 170.95657 165.3
[M+Na-2H]- 132.91739 119.4
[M]+ 111.94217 114.1
[M]- 111.94327 114.1
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