CID 2761541

56633-75-1

Structural Information

Molecular Formula

C₆H₁₁NO₂

SMILES

C1C[C@H](NC1)CC(=O)O

InChI

InChI=1S/C6H11NO2/c8-6(9)4-5-2-1-3-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1

InChIKey

ADSALMJPJUKESW-YFKPBYRVSA-N

Compound name

2-[(2S)-pyrrolidin-2-yl]acetic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 197
References: 1224
Patents: 129.07898 Da
Monoisotopic Mass: -2.4
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]+	130.08626	128.0
[M+Na]+	152.06820	133.6
[M-H]-	128.07170	127.0
[M+NH4]+	147.11280	148.7
[M+K]+	168.04214	132.1
[M+H-H2O]+	112.07624	122.4
[M+HCOO]-	174.07718	146.6
[M+CH3COO]-	188.09283	164.4
[M+Na-2H]-	150.05365	131.1
[M]+	129.07843	122.8
[M]-	129.07953	122.8

Literature stripe

literature stripe

Patent stripe

patents stripe