CID 10354306

148504-11-4

Structural Information

Molecular Formula
C11H15NO5
SMILES
C1=CC(=CC=C1N)O[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
InChI
InChI=1S/C11H15NO5/c12-6-1-3-7(4-2-6)16-11-10(15)9(14)8(5-13)17-11/h1-4,8-11,13-15H,5,12H2/t8-,9-,10-,11-/m1/s1
InChIKey
SLLMCDDTDIJDCF-GWOFURMSSA-N
Compound name
(2S,3R,4S,5R)-2-(4-aminophenoxy)-5-(hydroxymethyl)oxolane-3,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

241.09502 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.102296 150.8
[M+Na]+ 264.084238 157.5
[M-H]- 240.087744 154.2
[M+NH4]+ 259.128843 166.4
[M+K]+ 280.058178 155.7
[M+H-H2O]+ 224.092280 144.9
[M+HCOO]- 286.093221 169.9
[M+CH3COO]- 300.108871 186.4
[M+Na-2H]- 262.069686 152.4
[M]+ 241.09447142 148.9
[M]- 241.09556858 148.9
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

patents stripe