CID 16684366

Sodium mannitol antimonate

Structural Information

Molecular Formula
C6H13O8Sb
SMILES
C([C@@H]1[C@@H](O[Sb](=O)(O1)O)[C@@H]([C@@H](CO)O)O)O
InChI
InChI=1S/C6H12O6.H2O.O.Sb/c7-1-3(9)5(11)6(12)4(10)2-8;;;/h3-9,11H,1-2H2;1H2;;/q-2;;;+3/p-1/t3-,4-,5-,6-;;;/m1.../s1
InChIKey
KOCMATSAFMOGCH-KPGAZFBQSA-M
Compound name
(1R,2R)-1-[(4S,5R)-2-hydroxy-5-(hydroxymethyl)-2-oxo-1,3,2lambda5-dioxastibolan-4-yl]propane-1,2,3-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.96484 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.97212 160.8
[M+Na]+ 356.95406 164.9
[M+NH4]+ 351.99866 164.5
[M+K]+ 372.92800 166.0
[M-H]- 332.95756 157.8
[M+Na-2H]- 354.93951 158.0
[M]+ 333.96429 159.8
[M]- 333.96539 159.8
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.