CID 844893

2-chloro-n-[2-(piperidin-1-yl)phenyl]acetamide hydrochloride

Structural Information

Molecular Formula

C₁₃H₁₇ClN₂O

SMILES

C1CCN(CC1)C2=CC=CC=C2NC(=O)CCl

InChI

InChI=1S/C13H17ClN2O/c14-10-13(17)15-11-6-2-3-7-12(11)16-8-4-1-5-9-16/h2-3,6-7H,1,4-5,8-10H2,(H,15,17)

InChIKey

BKINZVMVEFFJLE-UHFFFAOYSA-N

Compound name

2-chloro-N-(2-piperidin-1-ylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 252.10294 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]+	253.110216	157.1
[M+Na]+	275.092158	161.9
[M-H]-	251.095664	161.1
[M+NH4]+	270.136763	172.9
[M+K]+	291.066098	157.3
[M+H-H2O]+	235.100200	149.4
[M+HCOO]-	297.101141	172.0
[M+CH3COO]-	311.116791	193.8
[M+Na-2H]-	273.077606	160.7
[M]+	252.10239142	153.9
[M]-	252.10348858	153.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe