CID 16684119

Dihydroxy(5-oxo-l-prolinato-n1,o2)aluminium

Structural Information

Molecular Formula
C5H6AlNO3
SMILES
C1CC(=O)NC1C(=O)O[Al]
InChI
InChI=1S/C5H7NO3.Al/c7-4-2-1-3(6-4)5(8)9;/h3H,1-2H2,(H,6,7)(H,8,9);/q;+1/p-1
InChIKey
XXMXSNSTXUNXBY-UHFFFAOYSA-M
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.01631 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.023586 129.2
[M+Na]+ 178.005528 136.4
[M-H]- 154.009034 129.9
[M+NH4]+ 173.050133 150.3
[M+K]+ 193.979468 135.8
[M+H-H2O]+ 138.013570 123.6
[M+HCOO]- 200.014511 149.7
[M+CH3COO]- 214.030161 168.7
[M+Na-2H]- 175.990976 132.2
[M]+ 155.01576142 127.0
[M]- 155.01685858 127.0
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.