CID 64617

127040-58-8

Structural Information

Molecular Formula

C₁₆H₂₄N₂O₂

SMILES

C1CC(=O)N(C1)CC(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C16H24N2O2/c19-14(9-18-3-1-2-15(18)20)17-16-12-5-10-4-11(7-12)8-13(16)6-10/h10-13,16H,1-9H2,(H,17,19)

InChIKey

XFUGTJLBWMDVJH-UHFFFAOYSA-N

Compound name

N-(2-adamantyl)-2-(2-oxopyrrolidin-1-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 9
References: 0
Patents: 276.18378 Da
Monoisotopic Mass: 1.5
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]+	277.191056	159.8
[M+Na]+	299.172998	159.5
[M-H]-	275.176504	156.0
[M+NH4]+	294.217603	180.8
[M+K]+	315.146938	156.1
[M+H-H2O]+	259.181040	153.1
[M+HCOO]-	321.181981	164.8
[M+CH3COO]-	335.197631	166.7
[M+Na-2H]-	297.158446	164.5
[M]+	276.18323142	157.2
[M]-	276.18432858	157.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.