CID 35855

((2-methoxyethoxy)methyl)benzene

Structural Information

Molecular Formula

C₁₀H₁₄O₂

SMILES

COCCOCC1=CC=CC=C1

InChI

InChI=1S/C10H14O2/c1-11-7-8-12-9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3

InChIKey

XBSQOKFFZZKPFM-UHFFFAOYSA-N

Compound name

2-methoxyethoxymethylbenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 367
Patents: 166.09938 Da
Monoisotopic Mass: 1.4
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]+	167.10666	135.1
[M+Na]+	189.08860	148.1
[M+NH4]+	184.13320	144.2
[M+K]+	205.06254	140.7
[M-H]-	165.09210	137.6
[M+Na-2H]-	187.07405	142.9
[M]+	166.09883	137.7
[M]-	166.09993	137.7

Literature stripe

literature stripe

Patent stripe

patents stripe