CID 106172528

2375270-58-7

Structural Information

Molecular Formula

C₇H₁₃F₂NO

SMILES

C1CCN(C1)CC(CO)(F)F

InChI

InChI=1S/C7H13F2NO/c8-7(9,6-11)5-10-3-1-2-4-10/h11H,1-6H2

InChIKey

VCEMHDAIKVSBMB-UHFFFAOYSA-N

Compound name

2,2-difluoro-3-pyrrolidin-1-ylpropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 165.09653 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]+	166.10381	137.9
[M+Na]+	188.08575	144.7
[M+NH4]+	183.13035	144.1
[M+K]+	204.05969	142.0
[M-H]-	164.08925	134.3
[M+Na-2H]-	186.07120	140.0
[M]+	165.09598	137.4
[M]-	165.09708	137.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe