CID 104613

2-[2-(1-naphthylamino)ethoxy]ethanol

Structural Information

Molecular Formula

C₁₄H₁₇NO₂

SMILES

C1=CC=C2C(=C1)C=CC=C2NCCOCCO

InChI

InChI=1S/C14H17NO2/c16-9-11-17-10-8-15-14-7-3-5-12-4-1-2-6-13(12)14/h1-7,15-16H,8-11H2

InChIKey

LKDJOSCYSCYSJE-UHFFFAOYSA-N

Compound name

2-[2-(naphthalen-1-ylamino)ethoxy]ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 5
Patents: 231.12593 Da
Monoisotopic Mass: 2.0
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]+	232.133206	150.6
[M+Na]+	254.115148	156.8
[M-H]-	230.118654	153.3
[M+NH4]+	249.159753	168.6
[M+K]+	270.089088	153.0
[M+H-H2O]+	214.123190	143.8
[M+HCOO]-	276.124131	173.4
[M+CH3COO]-	290.139781	191.3
[M+Na-2H]-	252.100596	158.7
[M]+	231.12538142	151.7
[M]-	231.12647858	151.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe