CID 217786

39629-96-4

Structural Information

Molecular Formula

C₁₅H₂₀N₂O₂

SMILES

CC(C)(C)NC(=O)C1CC(=O)N(C1)C2=CC=CC=C2

InChI

InChI=1S/C15H20N2O2/c1-15(2,3)16-14(19)11-9-13(18)17(10-11)12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3,(H,16,19)

InChIKey

FIZUJPHGFYEOBP-UHFFFAOYSA-N

Compound name

N-tert-butyl-5-oxo-1-phenylpyrrolidine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 8
Patents: 260.15247 Da
Monoisotopic Mass: 1.3
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]+	261.15975	162.0
[M+Na]+	283.14169	171.5
[M+NH4]+	278.18629	168.7
[M+K]+	299.11563	168.3
[M-H]-	259.14519	163.8
[M+Na-2H]-	281.12714	167.0
[M]+	260.15192	163.6
[M]-	260.15302	163.6

Literature stripe

literature stripe

Patent stripe

patents stripe