CID 16684067

Aluminum isopropoxide bis(2-ethylhexanoate)

Structural Information

Molecular Formula
C19H37AlO5
SMILES
CCCCC(CC)C(=O)O[Al](OCCC)OC(=O)C(CC)CCCC
InChI
InChI=1S/2C8H16O2.C3H7O.Al/c2*1-3-5-6-7(4-2)8(9)10;1-2-3-4;/h2*7H,3-6H2,1-2H3,(H,9,10);2-3H2,1H3;/q;;-1;+3/p-2
InChIKey
UOVYCPPGYLHLMN-UHFFFAOYSA-L
Compound name
[2-ethylhexanoyloxy(propoxy)alumanyl] 2-ethylhexanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

372.24564 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.25292 197.4
[M+Na]+ 395.23486 198.3
[M-H]- 371.23836 195.4
[M+NH4]+ 390.27946 209.4
[M+K]+ 411.20880 198.2
[M+H-H2O]+ 355.24290 190.2
[M+HCOO]- 417.24384 206.7
[M+CH3COO]- 431.25949 219.9
[M+Na-2H]- 393.22031 191.0
[M]+ 372.24509 206.5
[M]- 372.24619 206.5
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.