CID 18507

2-naphthylamine, 1-methoxy-, hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₁NO

SMILES

COC1=C(C=CC2=CC=CC=C21)N

InChI

InChI=1S/C11H11NO/c1-13-11-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,12H2,1H3

InChIKey

DZCCNHQOMASNEB-UHFFFAOYSA-N

Compound name

1-methoxynaphthalen-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 112
Patents: 173.08406 Da
Monoisotopic Mass: 2.5
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]+	174.091336	134.1
[M+Na]+	196.073278	143.2
[M-H]-	172.076784	138.8
[M+NH4]+	191.117883	155.4
[M+K]+	212.047218	140.1
[M+H-H2O]+	156.081320	128.2
[M+HCOO]-	218.082261	158.6
[M+CH3COO]-	232.097911	183.2
[M+Na-2H]-	194.058726	142.5
[M]+	173.08351142	134.1
[M]-	173.08460858	134.1

Literature stripe

literature stripe

Patent stripe

patents stripe