CID 70043

4-benzyloxybenzyl alcohol

Structural Information

Molecular Formula

C₁₄H₁₄O₂

SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CO

InChI

InChI=1S/C14H14O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-9,15H,10-11H2

InChIKey

OEBIVOHKFYSBPE-UHFFFAOYSA-N

Compound name

(4-phenylmethoxyphenyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 4821
Patents: 214.09938 Da
Monoisotopic Mass: 2.4
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	147.7
[M+Na]+	237.08860	162.7
[M+NH4]+	232.13320	157.0
[M+K]+	253.06254	154.4
[M-H]-	213.09210	152.5
[M+Na-2H]-	235.07405	157.8
[M]+	214.09883	151.3
[M]-	214.09993	151.3

Literature stripe

literature stripe

Patent stripe

patents stripe