CID 103439930

2763751-33-1

Structural Information

Molecular Formula

SMILES

CNC1(CC1)C(F)F

InChI

InChI=1S/C5H9F2N/c1-8-5(2-3-5)4(6)7/h4,8H,2-3H2,1H3

InChIKey

ATUNYOKCHADMFE-UHFFFAOYSA-N

Compound name

1-(difluoromethyl)-N-methylcyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 121.070305 Da
Monoisotopic Mass: 1.0
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]+	122.077581	117.8
[M+Na]+	144.059523	126.9
[M-H]-	120.063029	120.4
[M+NH4]+	139.104128	136.8
[M+K]+	160.033463	126.1
[M+H-H2O]+	104.067565	111.6
[M+HCOO]-	166.068506	140.0
[M+CH3COO]-	180.084156	176.9
[M+Na-2H]-	142.044971	125.2
[M]+	121.06975642	116.6
[M]-	121.07085358	116.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe