CID 424011

102107-41-5

Structural Information

Molecular Formula

C₁₀H₁₄ClNO

SMILES

CN(CC(C1=CC=CC=C1)Cl)OC

InChI

InChI=1S/C10H14ClNO/c1-12(13-2)8-10(11)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3

InChIKey

AXIBUDLKMBRJFH-UHFFFAOYSA-N

Compound name

2-chloro-N-methoxy-N-methyl-2-phenylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 199.07639 Da
Monoisotopic Mass: 2.4
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]+	200.083666	142.5
[M+Na]+	222.065608	149.3
[M-H]-	198.069114	147.2
[M+NH4]+	217.110213	162.9
[M+K]+	238.039548	147.4
[M+H-H2O]+	182.073650	136.9
[M+HCOO]-	244.074591	163.0
[M+CH3COO]-	258.090241	189.4
[M+Na-2H]-	220.051056	148.0
[M]+	199.07584142	146.2
[M]-	199.07693858	146.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.