CID 80604390

Akos019170857

Structural Information

Molecular Formula

C₆H₁₀F₂O₂

SMILES

C1COCC1C(C(F)F)O

InChI

InChI=1S/C6H10F2O2/c7-6(8)5(9)4-1-2-10-3-4/h4-6,9H,1-3H2

InChIKey

VVYCCBMCOAPDKF-UHFFFAOYSA-N

Compound name

2,2-difluoro-1-(oxolan-3-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 152.06488 Da
Monoisotopic Mass: 0.7
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]+	153.07216	129.6
[M+Na]+	175.05410	135.1
[M-H]-	151.05760	129.2
[M+NH4]+	170.09870	150.0
[M+K]+	191.02804	135.6
[M+H-H2O]+	135.06214	123.1
[M+HCOO]-	197.06308	146.7
[M+CH3COO]-	211.07873	171.6
[M+Na-2H]-	173.03955	131.9
[M]+	152.06433	124.0
[M]-	152.06543	124.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.