CID 90476538

70815-16-6

Structural Information

Molecular Formula
C18H39AlO9
SMILES
CCOCCOCCO[Al](OCCOCCOCC)OCCOCCOCC
InChI
InChI=1S/3C6H13O3.Al/c3*1-2-8-5-6-9-4-3-7;/h3*2-6H2,1H3;/q3*-1;+3
InChIKey
OEJSTGAKVVRHER-UHFFFAOYSA-N
Compound name
tris[2-(2-ethoxyethoxy)ethoxy]alumane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

426.24094 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 427.24822 215.1
[M+Na]+ 449.23016 219.3
[M-H]- 425.23366 205.7
[M+NH4]+ 444.27476 219.0
[M+K]+ 465.20410 213.3
[M+H-H2O]+ 409.23820 191.6
[M+HCOO]- 471.23914 228.4
[M+CH3COO]- 485.25479 224.1
[M+Na-2H]- 447.21561 202.9
[M]+ 426.24039 217.1
[M]- 426.24149 217.1
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.