CID 84038895

2792185-51-2

Structural Information

Molecular Formula

C₁₁H₁₁NO

SMILES

C1=CC2=C(C=CC(=C2)CN)C(=C1)O

InChI

InChI=1S/C11H11NO/c12-7-8-4-5-10-9(6-8)2-1-3-11(10)13/h1-6,13H,7,12H2

InChIKey

VMXLANQFGTYZMD-UHFFFAOYSA-N

Compound name

6-(aminomethyl)naphthalen-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 173.08406 Da
Monoisotopic Mass: 1.7
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]+	174.091336	134.4
[M+Na]+	196.073278	143.1
[M-H]-	172.076784	137.7
[M+NH4]+	191.117883	155.0
[M+K]+	212.047218	139.1
[M+H-H2O]+	156.081320	128.9
[M+HCOO]-	218.082261	157.4
[M+CH3COO]-	232.097911	180.7
[M+Na-2H]-	194.058726	142.4
[M]+	173.08351142	132.5
[M]-	173.08460858	132.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe