CID 155819858

2741262-68-8

Structural Information

Molecular Formula
C5H11NO3
SMILES
C1C[C@H]([C@@H]([C@@H]1O)O)ON
InChI
InChI=1S/C5H11NO3/c6-9-4-2-1-3(7)5(4)8/h3-5,7-8H,1-2,6H2/t3-,4-,5-/m1/s1
InChIKey
IRCLZMIZZHBGOF-UOWFLXDJSA-N
Compound name
(1R,2R,3R)-3-aminooxycyclopentane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.0739 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.08118 125.2
[M+Na]+ 156.06312 132.0
[M-H]- 132.06662 125.7
[M+NH4]+ 151.10772 147.0
[M+K]+ 172.03706 130.9
[M+H-H2O]+ 116.07116 120.6
[M+HCOO]- 178.07210 146.7
[M+CH3COO]- 192.08775 167.6
[M+Na-2H]- 154.04857 128.2
[M]+ 133.07335 120.9
[M]- 133.07445 120.9
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

No patent data available for this compound.