CID 16682988

Aluminum monostearate

Structural Information

Molecular Formula
C18H35AlO2
SMILES
CCCCCCCCCCCCCCCCCC(=O)O[Al]
InChI
InChI=1S/C18H36O2.Al/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1
InChIKey
RMHMCAVBXYSACO-UHFFFAOYSA-M
Compound name
None
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

2612
References

133301
Patents

310.24524 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.25252 184.8
[M+Na]+ 333.23446 186.8
[M-H]- 309.23796 182.7
[M+NH4]+ 328.27906 200.3
[M+K]+ 349.20840 183.9
[M+H-H2O]+ 293.24250 177.8
[M+HCOO]- 355.24344 204.0
[M+CH3COO]- 369.25909 209.5
[M+Na-2H]- 331.21991 183.6
[M]+ 310.24469 192.6
[M]- 310.24579 192.6
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.