CID 13542895

2,4-dimethoxy-1-(methoxymethyl)benzene

Structural Information

Molecular Formula

C₁₀H₁₄O₃

SMILES

COCC1=C(C=C(C=C1)OC)OC

InChI

InChI=1S/C10H14O3/c1-11-7-8-4-5-9(12-2)6-10(8)13-3/h4-6H,7H2,1-3H3

InChIKey

BRRSPLOMTXEJRC-UHFFFAOYSA-N

Compound name

2,4-dimethoxy-1-(methoxymethyl)benzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 182.0943 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]+	183.101576	136.7
[M+Na]+	205.083518	145.5
[M-H]-	181.087024	140.9
[M+NH4]+	200.128123	157.3
[M+K]+	221.057458	145.0
[M+H-H2O]+	165.091560	131.0
[M+HCOO]-	227.092501	161.7
[M+CH3COO]-	241.108151	182.7
[M+Na-2H]-	203.068966	143.1
[M]+	182.09375142	142.2
[M]-	182.09484858	142.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe