CID 16684358

Hydroxychloro(allantoinato)aluminum

Structural Information

Molecular Formula
C4H5AlClN4O3
SMILES
C1(C(=O)NC(=O)N1)NC(=O)N[Al]Cl
InChI
InChI=1S/C4H6N4O3.Al.ClH/c5-3(10)6-1-2(9)8-4(11)7-1;;/h1H,(H5,5,6,7,8,9,10,11);;1H/q;+2;/p-2
InChIKey
RWTXUQXECBSYDJ-UHFFFAOYSA-L
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.98656 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.99384 140.8
[M+Na]+ 241.97578 147.3
[M+NH4]+ 237.02038 145.2
[M+K]+ 257.94972 146.5
[M-H]- 217.97928 138.1
[M+Na-2H]- 239.96123 141.6
[M]+ 218.98601 140.3
[M]- 218.98711 140.3
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.