CID 60922939

795299-76-2

Structural Information

Molecular Formula

C₅H₁₂F₂N₂

SMILES

CN(CCN)CC(F)F

InChI

InChI=1S/C5H12F2N2/c1-9(3-2-8)4-5(6)7/h5H,2-4,8H2,1H3

InChIKey

HZWVDKDSDLHMCO-UHFFFAOYSA-N

Compound name

N'-(2,2-difluoroethyl)-N'-methylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 138.09685 Da
Monoisotopic Mass: 0.2
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]+	139.10413	128.2
[M+Na]+	161.08607	134.0
[M-H]-	137.08957	126.7
[M+NH4]+	156.13067	149.6
[M+K]+	177.06001	134.7
[M+H-H2O]+	121.09411	120.9
[M+HCOO]-	183.09505	151.0
[M+CH3COO]-	197.11070	183.0
[M+Na-2H]-	159.07152	131.8
[M]+	138.09630	124.5
[M]-	138.09740	124.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.