CID 12022970

[4-(ethoxymethoxy)phenyl]methanol

Structural Information

Molecular Formula

C₁₀H₁₄O₃

SMILES

CCOCOC1=CC=C(C=C1)CO

InChI

InChI=1S/C10H14O3/c1-2-12-8-13-10-5-3-9(7-11)4-6-10/h3-6,11H,2,7-8H2,1H3

InChIKey

VXTLFGATOHUJQY-UHFFFAOYSA-N

Compound name

[4-(ethoxymethoxy)phenyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 182.0943 Da
Monoisotopic Mass: 1.3
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]+	183.101576	138.1
[M+Na]+	205.083518	145.5
[M-H]-	181.087024	140.4
[M+NH4]+	200.128123	157.5
[M+K]+	221.057458	144.0
[M+H-H2O]+	165.091560	132.3
[M+HCOO]-	227.092501	161.5
[M+CH3COO]-	241.108151	178.9
[M+Na-2H]-	203.068966	144.6
[M]+	182.09375142	141.2
[M]-	182.09484858	141.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe