CID 15573

1708-42-5

Structural Information

Molecular Formula

C₈H₁₀O₄

SMILES

C1C(OC(O1)C2=CC=CO2)CO

InChI

InChI=1S/C8H10O4/c9-4-6-5-11-8(12-6)7-2-1-3-10-7/h1-3,6,8-9H,4-5H2

InChIKey

BKRXMKVDYAWYHS-UHFFFAOYSA-N

Compound name

[2-(furan-2-yl)-1,3-dioxolan-4-yl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 170.0579 Da
Monoisotopic Mass: -0.2
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]+	171.06518	132.1
[M+Na]+	193.04712	142.4
[M+NH4]+	188.09172	140.0
[M+K]+	209.02106	142.8
[M-H]-	169.05062	137.6
[M+Na-2H]-	191.03257	135.8
[M]+	170.05735	134.9
[M]-	170.05845	134.9

Literature stripe

literature stripe

Patent stripe

patents stripe