CID 4820

Pilsicainide

Structural Information

Molecular Formula

C₁₇H₂₄N₂O

SMILES

CC1=C(C(=CC=C1)C)NC(=O)CC23CCCN2CCC3

InChI

InChI=1S/C17H24N2O/c1-13-6-3-7-14(2)16(13)18-15(20)12-17-8-4-10-19(17)11-5-9-17/h3,6-7H,4-5,8-12H2,1-2H3,(H,18,20)

InChIKey

BCQTVJKBTWGHCX-UHFFFAOYSA-N

Compound name

N-(2,6-dimethylphenyl)-2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 261
References: 1411
Patents: 272.18887 Da
Monoisotopic Mass: 2.7
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]+	273.19615	166.8
[M+Na]+	295.17809	172.2
[M-H]-	271.18159	172.6
[M+NH4]+	290.22269	187.9
[M+K]+	311.15203	168.3
[M+H-H2O]+	255.18613	159.8
[M+HCOO]-	317.18707	186.4
[M+CH3COO]-	331.20272	200.4
[M+Na-2H]-	293.16354	167.0
[M]+	272.18832	163.9
[M]-	272.18942	163.9

Literature stripe

literature stripe

Patent stripe

patents stripe