CID 208446

32184-20-6

Structural Information

Molecular Formula

C₁₀H₁₄ClN

SMILES

CN(C)CC(C1=CC=CC=C1)Cl

InChI

InChI=1S/C10H14ClN/c1-12(2)8-10(11)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3

InChIKey

BHDHMUNVUMGSIY-UHFFFAOYSA-N

Compound name

2-chloro-N,N-dimethyl-2-phenylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 183.08148 Da
Monoisotopic Mass: 2.8
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]+	184.08876	139.4
[M+Na]+	206.07070	146.2
[M-H]-	182.07420	144.0
[M+NH4]+	201.11530	160.5
[M+K]+	222.04464	143.8
[M+H-H2O]+	166.07874	134.0
[M+HCOO]-	228.07968	159.6
[M+CH3COO]-	242.09533	187.5
[M+Na-2H]-	204.05615	144.9
[M]+	183.08093	141.6
[M]-	183.08203	141.6

Literature stripe

literature stripe

Patent stripe

patents stripe