CID 53930

77966-67-7

Structural Information

Molecular Formula

C₁₄H₁₉ClN₂O

SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)CN2CCCCC2

InChI

InChI=1S/C14H19ClN2O/c1-11-6-5-7-12(15)14(11)16-13(18)10-17-8-3-2-4-9-17/h5-7H,2-4,8-10H2,1H3,(H,16,18)

InChIKey

BTAUHKMPJMOMTP-UHFFFAOYSA-N

Compound name

N-(2-chloro-6-methylphenyl)-2-piperidin-1-ylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 266.1186 Da
Monoisotopic Mass: 2.1
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]+	267.125876	161.8
[M+Na]+	289.107818	167.1
[M-H]-	265.111324	166.0
[M+NH4]+	284.152423	177.3
[M+K]+	305.081758	162.2
[M+H-H2O]+	249.115860	154.1
[M+HCOO]-	311.116801	176.4
[M+CH3COO]-	325.132451	197.9
[M+Na-2H]-	287.093266	164.1
[M]+	266.11805142	159.3
[M]-	266.11914858	159.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe