CID 10855985

2-(fur-2-yl)benzyl alcohol

Structural Information

Molecular Formula

C₁₁H₁₀O₂

SMILES

C1=CC=C(C(=C1)CO)C2=CC=CO2

InChI

InChI=1S/C11H10O2/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-7,12H,8H2

InChIKey

NBLMKRIYULDNBF-UHFFFAOYSA-N

Compound name

[2-(furan-2-yl)phenyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 174.06808 Da
Monoisotopic Mass: 1.8
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]+	175.075356	134.1
[M+Na]+	197.057298	142.6
[M-H]-	173.060804	140.7
[M+NH4]+	192.101903	154.2
[M+K]+	213.031238	140.8
[M+H-H2O]+	157.065340	128.4
[M+HCOO]-	219.066281	158.4
[M+CH3COO]-	233.081931	175.4
[M+Na-2H]-	195.042746	141.1
[M]+	174.06753142	135.0
[M]-	174.06862858	135.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe