CID 21298714

2-chloro-2,2-difluoroethan-1-amine hydrochloride

Structural Information

Molecular Formula

C₂H₄ClF₂N

SMILES

C(C(F)(F)Cl)N

InChI

InChI=1S/C2H4ClF2N/c3-2(4,5)1-6/h1,6H2

InChIKey

SAOIWALCPKHWQI-UHFFFAOYSA-N

Compound name

2-chloro-2,2-difluoroethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 44
Patents: 115.00003 Da
Monoisotopic Mass: 0.6
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]+	116.00731	114.8
[M+Na]+	137.98925	124.1
[M-H]-	113.99275	112.5
[M+NH4]+	133.03385	137.8
[M+K]+	153.96319	121.8
[M+H-H2O]+	97.997290	110.4
[M+HCOO]-	159.99823	132.1
[M+CH3COO]-	174.01388	168.9
[M+Na-2H]-	135.97470	122.2
[M]+	114.99948	111.5
[M]-	115.00058	111.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe