CID 9793712

190792-70-2

Structural Information

Molecular Formula

SMILES

C1[C@@H]([C@H](CO1)O)N

InChI

InChI=1S/C4H9NO2/c5-3-1-7-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4-/m0/s1

InChIKey

HQVKXDYSIGDGSY-IMJSIDKUSA-N

Compound name

(3R,4S)-4-aminooxolan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 466
Patents: 103.06333 Da
Monoisotopic Mass: -1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	104.070606	118.0
[M+Na]+	126.052548	124.9
[M-H]-	102.056054	120.4
[M+NH4]+	121.097153	140.3
[M+K]+	142.026488	125.3
[M+H-H2O]+	86.060590	113.4
[M+HCOO]-	148.061531	140.2
[M+CH3COO]-	162.077181	163.6
[M+Na-2H]-	124.037996	123.6
[M]+	103.06278142	114.0
[M]-	103.06387858	114.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe