CID 54371871

2173998-75-7

Structural Information

Molecular Formula

C₆H₁₀N₂O₃

SMILES

C1C(CNC1=O)NCC(=O)O

InChI

InChI=1S/C6H10N2O3/c9-5-1-4(2-8-5)7-3-6(10)11/h4,7H,1-3H2,(H,8,9)(H,10,11)

InChIKey

UTTREVXNOTZAKF-UHFFFAOYSA-N

Compound name

2-[(5-oxopyrrolidin-3-yl)amino]acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 158.06914 Da
Monoisotopic Mass: -3.8
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]+	159.07642	133.3
[M+Na]+	181.05836	140.0
[M+NH4]+	176.10296	139.0
[M+K]+	197.03230	138.9
[M-H]-	157.06186	131.5
[M+Na-2H]-	179.04381	134.8
[M]+	158.06859	133.0
[M]-	158.06969	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe