CID 49385

N-(2-(2-oxo-1-pyrrolidinyl)ethyl)acetamide

Structural Information

Molecular Formula

C₈H₁₄N₂O₂

SMILES

CC(=O)NCCN1CCCC1=O

InChI

InChI=1S/C8H14N2O2/c1-7(11)9-4-6-10-5-2-3-8(10)12/h2-6H2,1H3,(H,9,11)

InChIKey

YIDRCZQGTWNIHB-UHFFFAOYSA-N

Compound name

N-[2-(2-oxopyrrolidin-1-yl)ethyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 170.10553 Da
Monoisotopic Mass: -0.9
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]+	171.112806	137.7
[M+Na]+	193.094748	143.7
[M-H]-	169.098254	139.5
[M+NH4]+	188.139353	158.1
[M+K]+	209.068688	142.8
[M+H-H2O]+	153.102790	131.2
[M+HCOO]-	215.103731	159.9
[M+CH3COO]-	229.119381	180.2
[M+Na-2H]-	191.080196	140.5
[M]+	170.10498142	135.9
[M]-	170.10607858	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe