CID 215124

35041-91-9

Structural Information

Molecular Formula

C₁₀H₁₄ClN₃OS

SMILES

C1CCN(CC1)CC(=O)NC2=NC=C(S2)Cl

InChI

InChI=1S/C10H14ClN3OS/c11-8-6-12-10(16-8)13-9(15)7-14-4-2-1-3-5-14/h6H,1-5,7H2,(H,12,13,15)

InChIKey

SGVDHJVPMKWTPE-UHFFFAOYSA-N

Compound name

N-(5-chloro-1,3-thiazol-2-yl)-2-piperidin-1-ylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 259.0546 Da
Monoisotopic Mass: 2.3
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]+	260.061876	156.2
[M+Na]+	282.043818	162.6
[M-H]-	258.047324	159.8
[M+NH4]+	277.088423	173.0
[M+K]+	298.017758	158.3
[M+H-H2O]+	242.051860	148.8
[M+HCOO]-	304.052801	166.5
[M+CH3COO]-	318.068451	191.1
[M+Na-2H]-	280.029266	155.9
[M]+	259.05405142	155.4
[M]-	259.05514858	155.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.