CID 720977

292644-30-5

Structural Information

Molecular Formula

C₁₁H₈Cl₂O₂

SMILES

C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)CO

InChI

InChI=1S/C11H8Cl2O2/c12-7-1-3-9(10(13)5-7)11-4-2-8(6-14)15-11/h1-5,14H,6H2

InChIKey

GTXVKLIDWYHAAS-UHFFFAOYSA-N

Compound name

[5-(2,4-dichlorophenyl)furan-2-yl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 3
Patents: 241.99013 Da
Monoisotopic Mass: 3.1
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]+	242.99741	147.2
[M+Na]+	264.97935	163.0
[M+NH4]+	260.02395	156.7
[M+K]+	280.95329	156.9
[M-H]-	240.98285	152.2
[M+Na-2H]-	262.96480	155.1
[M]+	241.98958	151.6
[M]-	241.99068	151.6

Literature stripe

literature stripe

Patent stripe

patents stripe