CID 203854

1-pyrrolidineacetamide, n-phenyl-

Structural Information

Molecular Formula

C₁₂H₁₆N₂O

SMILES

C1CCN(C1)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H16N2O/c15-12(10-14-8-4-5-9-14)13-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,13,15)

InChIKey

CIOIRYLEIVBXJB-UHFFFAOYSA-N

Compound name

N-phenyl-2-pyrrolidin-1-ylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 16
Patents: 204.12627 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]+	205.13355	148.0
[M+Na]+	227.11549	158.1
[M+NH4]+	222.16009	156.2
[M+K]+	243.08943	153.4
[M-H]-	203.11899	151.2
[M+Na-2H]-	225.10094	154.8
[M]+	204.12572	150.0
[M]-	204.12682	150.0

Literature stripe

literature stripe

Patent stripe

patents stripe