CID 105530017

4,4-difluorotetrahydrofuran-3-ol

Structural Information

Molecular Formula

C₄H₆F₂O₂

SMILES

C1C(C(CO1)(F)F)O

InChI

InChI=1S/C4H6F2O2/c5-4(6)2-8-1-3(4)7/h3,7H,1-2H2

InChIKey

PVWAPSUNVVAGKE-UHFFFAOYSA-N

Compound name

4,4-difluorooxolan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 72
Patents: 124.033585 Da
Monoisotopic Mass: -0.1
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]+	125.04086	116.9
[M+Na]+	147.02280	125.7
[M-H]-	123.02631	117.6
[M+NH4]+	142.06741	141.0
[M+K]+	162.99674	126.0
[M+H-H2O]+	107.03084	112.0
[M+HCOO]-	169.03179	136.8
[M+CH3COO]-	183.04744	164.5
[M+Na-2H]-	145.00825	123.6
[M]+	124.03304	112.7
[M]-	124.03413	112.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe