CID 51260

71186-32-8

Structural Information

Molecular Formula

C₅H₁₁BrFN

SMILES

CN(CCF)CCBr

InChI

InChI=1S/C5H11BrFN/c1-8(4-2-6)5-3-7/h2-5H2,1H3

InChIKey

YIKWUNYEHWRWQU-UHFFFAOYSA-N

Compound name

N-(2-bromoethyl)-2-fluoro-N-methylethanamine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 183.00589 Da
Monoisotopic Mass: 1.4
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]+	184.013166	132.7
[M+Na]+	205.995108	143.0
[M-H]-	181.998614	135.7
[M+NH4]+	201.039713	156.4
[M+K]+	221.969048	133.8
[M+H-H2O]+	166.003150	131.8
[M+HCOO]-	228.004091	154.5
[M+CH3COO]-	242.019741	185.7
[M+Na-2H]-	203.980556	140.0
[M]+	183.00534142	151.0
[M]-	183.00643858	151.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.