CID 96375

(2-methoxyethoxy)benzene

Structural Information

Molecular Formula

C₉H₁₂O₂

SMILES

COCCOC1=CC=CC=C1

InChI

InChI=1S/C9H12O2/c1-10-7-8-11-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3

InChIKey

IFQVEYUAIINTRX-UHFFFAOYSA-N

Compound name

2-methoxyethoxybenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 554
References: 1785
Patents: 152.08372 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]+	153.09100	130.6
[M+Na]+	175.07294	143.7
[M+NH4]+	170.11754	139.8
[M+K]+	191.04688	136.6
[M-H]-	151.07644	133.1
[M+Na-2H]-	173.05839	138.6
[M]+	152.08317	133.2
[M]-	152.08427	133.2

Literature stripe

literature stripe

Patent stripe

patents stripe