CID 3018929

Benzene, 1-methoxy-4-(2-methoxyethyl)-

Structural Information

Molecular Formula

C₁₀H₁₄O₂

SMILES

COCCC1=CC=C(C=C1)OC

InChI

InChI=1S/C10H14O2/c1-11-8-7-9-3-5-10(12-2)6-4-9/h3-6H,7-8H2,1-2H3

InChIKey

VRHBKUJDGWQGPD-UHFFFAOYSA-N

Compound name

1-methoxy-4-(2-methoxyethyl)benzene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 63
Patents: 166.09938 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]+	167.106656	134.3
[M+Na]+	189.088598	142.2
[M-H]-	165.092104	138.1
[M+NH4]+	184.133203	155.2
[M+K]+	205.062538	141.2
[M+H-H2O]+	149.096640	128.6
[M+HCOO]-	211.097581	159.1
[M+CH3COO]-	225.113231	179.5
[M+Na-2H]-	187.074046	141.4
[M]+	166.09883142	137.9
[M]-	166.09992858	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe