CID 11051776

122151-38-6

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C[C@@H](C(=O)N1CCCC1)O

InChI

InChI=1S/C7H13NO2/c1-6(9)7(10)8-4-2-3-5-8/h6,9H,2-5H2,1H3/t6-/m0/s1

InChIKey

KLCGBSXTJWOEJD-LURJTMIESA-N

Compound name

(2S)-2-hydroxy-1-pyrrolidin-1-ylpropan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 53
Patents: 143.09464 Da
Monoisotopic Mass: 0.0
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]+	144.10192	132.2
[M+Na]+	166.08386	140.3
[M+NH4]+	161.12846	139.4
[M+K]+	182.05780	138.4
[M-H]-	142.08736	131.2
[M+Na-2H]-	164.06931	134.8
[M]+	143.09409	132.6
[M]-	143.09519	132.6

Literature stripe

literature stripe

Patent stripe

patents stripe