CID 611778

2-benzyl-4-methoxyphenol

Structural Information

Molecular Formula

C₁₄H₁₄O₂

SMILES

COC1=CC(=C(C=C1)O)CC2=CC=CC=C2

InChI

InChI=1S/C14H14O2/c1-16-13-7-8-14(15)12(10-13)9-11-5-3-2-4-6-11/h2-8,10,15H,9H2,1H3

InChIKey

ZCVHLCUGDIPDLI-UHFFFAOYSA-N

Compound name

2-benzyl-4-methoxyphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
Patents: 214.09938 Da
Monoisotopic Mass: 3.5
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]+	215.10666	147.2
[M+Na]+	237.08860	162.6
[M+NH4]+	232.13320	156.5
[M+K]+	253.06254	154.5
[M-H]-	213.09210	152.1
[M+Na-2H]-	235.07405	157.2
[M]+	214.09883	151.0
[M]-	214.09993	151.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe