CID 58398153

2170129-90-3

Structural Information

Molecular Formula

SMILES

CC(CNC)(F)F

InChI

InChI=1S/C4H9F2N/c1-4(5,6)3-7-2/h7H,3H2,1-2H3

InChIKey

DEGJSQCUKWESJF-UHFFFAOYSA-N

Compound name

2,2-difluoro-N-methylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 79
Patents: 109.070305 Da
Monoisotopic Mass: 0.5
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]+	110.077581	118.3
[M+Na]+	132.059523	126.0
[M-H]-	108.063029	116.4
[M+NH4]+	127.104128	141.1
[M+K]+	148.033463	125.9
[M+H-H2O]+	92.067565	112.7
[M+HCOO]-	154.068506	140.1
[M+CH3COO]-	168.084156	171.8
[M+Na-2H]-	130.044971	126.1
[M]+	109.06975642	115.1
[M]-	109.07085358	115.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe