CID 16682994

Bis(acetato-o)hydroxyaluminium

Structural Information

Molecular Formula
C4H6AlO4
SMILES
CC(=O)O[Al]OC(=O)C
InChI
InChI=1S/2C2H4O2.Al/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
InChIKey
WFWGHTHPSMLCFS-UHFFFAOYSA-L
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

1027
Patents

145.00815 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.01543 124.5
[M+Na]+ 167.99737 132.3
[M-H]- 144.00087 125.1
[M+NH4]+ 163.04197 146.5
[M+K]+ 183.97131 134.0
[M+H-H2O]+ 128.00541 120.0
[M+HCOO]- 190.00635 148.0
[M+CH3COO]- 204.02200 170.7
[M+Na-2H]- 165.98282 129.7
[M]+ 145.00760 128.4
[M]- 145.00870 128.4
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.