CID 263034

Difurfuryl ether

Structural Information

Molecular Formula

C₁₀H₁₀O₃

SMILES

C1=COC(=C1)COCC2=CC=CO2

InChI

InChI=1S/C10H10O3/c1-3-9(12-5-1)7-11-8-10-4-2-6-13-10/h1-6H,7-8H2

InChIKey

YEQMNLGBLPBBNI-UHFFFAOYSA-N

Compound name

2-(furan-2-ylmethoxymethyl)furan

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 1
References: 598
Patents: 178.06299 Da
Monoisotopic Mass: 1.3
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]+	179.070266	133.1
[M+Na]+	201.052208	142.4
[M-H]-	177.055714	141.7
[M+NH4]+	196.096813	153.9
[M+K]+	217.026148	143.3
[M+H-H2O]+	161.060250	128.2
[M+HCOO]-	223.061191	160.6
[M+CH3COO]-	237.076841	176.3
[M+Na-2H]-	199.037656	141.1
[M]+	178.06244142	139.3
[M]-	178.06353858	139.3

Literature stripe

literature stripe

Patent stripe

patents stripe