CID 10725920

220812-17-9

Structural Information

Molecular Formula

C₄H₁₀N₂O

SMILES

C1[C@H]([C@@H](CN1)O)N

InChI

InChI=1S/C4H10N2O/c5-3-1-6-2-4(3)7/h3-4,6-7H,1-2,5H2/t3-,4-/m1/s1

InChIKey

ZCZJKVCIYONNJR-QWWZWVQMSA-N

Compound name

(3R,4R)-4-aminopyrrolidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 102.079315 Da
Monoisotopic Mass: -1.9
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]+	103.08659	120.0
[M+Na]+	125.06853	126.5
[M-H]-	101.07204	119.0
[M+NH4]+	120.11314	141.6
[M+K]+	141.04247	124.7
[M+H-H2O]+	85.076575	114.6
[M+HCOO]-	147.07752	140.2
[M+CH3COO]-	161.09317	161.7
[M+Na-2H]-	123.05398	124.0
[M]+	102.07877	112.6
[M]-	102.07986	112.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe