CID 90476771

85339-17-9

Structural Information

Molecular Formula
C8H15NO7
SMILES
CC(=O)N([C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O
InChI
InChI=1S/C8H15NO7/c1-3(11)9(15)8-7(14)6(13)5(12)4(2-10)16-8/h4-8,10,12-15H,2H2,1H3/t4-,5+,6+,7-,8-/m1/s1
InChIKey
XNGRTBJPTAUBTF-DWOUCZDBSA-N
Compound name
N-hydroxy-N-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.08485 Da
Monoisotopic Mass

-2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.09213 149.0
[M+Na]+ 260.07407 154.0
[M-H]- 236.07757 148.0
[M+NH4]+ 255.11867 162.4
[M+K]+ 276.04801 154.9
[M+H-H2O]+ 220.08211 143.6
[M+HCOO]- 282.08305 163.0
[M+CH3COO]- 296.09870 186.0
[M+Na-2H]- 258.05952 149.2
[M]+ 237.08430 146.4
[M]- 237.08540 146.4
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.