CID 80006

2,2'-bifuran

Structural Information

Molecular Formula

C₈H₆O₂

SMILES

C1=COC(=C1)C2=CC=CO2

InChI

InChI=1S/C8H6O2/c1-3-7(9-5-1)8-4-2-6-10-8/h1-6H

InChIKey

UDHZFLBMZZVHRA-UHFFFAOYSA-N

Compound name

2-(furan-2-yl)furan

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8567
References: 31850
Patents: 134.03677 Da
Monoisotopic Mass: 1.7
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]+	135.044046	120.4
[M+Na]+	157.025988	130.6
[M-H]-	133.029494	129.3
[M+NH4]+	152.070593	143.1
[M+K]+	172.999928	131.6
[M+H-H2O]+	117.034030	116.0
[M+HCOO]-	179.034971	148.3
[M+CH3COO]-	193.050621	137.2
[M+Na-2H]-	155.011436	129.5
[M]+	134.03622142	124.5
[M]-	134.03731858	124.5

Literature stripe

literature stripe

Patent stripe

patents stripe