CID 216310

57115-99-8

Structural Information

Molecular Formula

C₁₆H₂₄N₂O

SMILES

CC1=CC(=C(C(=C1C)NC(=O)CN2CCCC2)C)C

InChI

InChI=1S/C16H24N2O/c1-11-9-12(2)14(4)16(13(11)3)17-15(19)10-18-7-5-6-8-18/h9H,5-8,10H2,1-4H3,(H,17,19)

InChIKey

VPFPCVIXJCJDJG-UHFFFAOYSA-N

Compound name

2-pyrrolidin-1-yl-N-(2,3,5,6-tetramethylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 260.18887 Da
Monoisotopic Mass: 3.1
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]+	261.196146	163.9
[M+Na]+	283.178088	170.4
[M-H]-	259.181594	169.4
[M+NH4]+	278.222693	181.5
[M+K]+	299.152028	166.9
[M+H-H2O]+	243.186130	156.4
[M+HCOO]-	305.187071	184.7
[M+CH3COO]-	319.202721	202.2
[M+Na-2H]-	281.163536	162.8
[M]+	260.18832142	163.0
[M]-	260.18941858	163.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.