CID 106172548

2305252-90-6

Structural Information

Molecular Formula

C₅H₁₁F₂NO

SMILES

CN(C)CC(CO)(F)F

InChI

InChI=1S/C5H11F2NO/c1-8(2)3-5(6,7)4-9/h9H,3-4H2,1-2H3

InChIKey

GNYVMKMFYGISQP-UHFFFAOYSA-N

Compound name

3-(dimethylamino)-2,2-difluoropropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 139.08087 Da
Monoisotopic Mass: 0.3
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]+	140.08815	126.3
[M+Na]+	162.07009	133.4
[M-H]-	138.07359	124.3
[M+NH4]+	157.11469	147.8
[M+K]+	178.04403	133.8
[M+H-H2O]+	122.07813	120.4
[M+HCOO]-	184.07907	147.1
[M+CH3COO]-	198.09472	177.6
[M+Na-2H]-	160.05554	132.3
[M]+	139.08032	124.2
[M]-	139.08142	124.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe