CID 110366

2-(2,2-dimethoxyethoxy)naphthalene

Structural Information

Molecular Formula

C₁₄H₁₆O₃

SMILES

COC(COC1=CC2=CC=CC=C2C=C1)OC

InChI

InChI=1S/C14H16O3/c1-15-14(16-2)10-17-13-8-7-11-5-3-4-6-12(11)9-13/h3-9,14H,10H2,1-2H3

InChIKey

CFMNTNDYLXCBPP-UHFFFAOYSA-N

Compound name

2-(2,2-dimethoxyethoxy)naphthalene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 232.10994 Da
Monoisotopic Mass: 3.3
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]+	233.117216	151.1
[M+Na]+	255.099158	158.2
[M-H]-	231.102664	155.4
[M+NH4]+	250.143763	170.0
[M+K]+	271.073098	156.4
[M+H-H2O]+	215.107200	144.2
[M+HCOO]-	277.108141	173.5
[M+CH3COO]-	291.123791	191.9
[M+Na-2H]-	253.084606	157.9
[M]+	232.10939142	155.5
[M]-	232.11048858	155.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.