CID 11788308

(2s)-1-(aminooxy)propan-2-ol

Structural Information

Molecular Formula
C3H9NO2
SMILES
C[C@@H](CON)O
InChI
InChI=1S/C3H9NO2/c1-3(5)2-6-4/h3,5H,2,4H2,1H3/t3-/m0/s1
InChIKey
NDJYVTLJWDGQGL-VKHMYHEASA-N
Compound name
(2S)-1-aminooxypropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

102
Patents

91.06333 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 92.070606 116.7
[M+Na]+ 114.05255 123.6
[M-H]- 90.056054 115.5
[M+NH4]+ 109.09715 139.1
[M+K]+ 130.02649 124.2
[M+H-H2O]+ 74.060590 112.4
[M+HCOO]- 136.06153 139.8
[M+CH3COO]- 150.07718 164.3
[M+Na-2H]- 112.03800 122.6
[M]+ 91.062781 115.3
[M]- 91.063879 115.3
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

patents stripe