CID 129606167

2102412-83-7

Structural Information

Molecular Formula

C₇H₁₂F₃N

SMILES

C1CC(C1)(CCN)C(F)(F)F

InChI

InChI=1S/C7H12F3N/c8-7(9,10)6(4-5-11)2-1-3-6/h1-5,11H2

InChIKey

XAPDKINLWUOIIP-UHFFFAOYSA-N

Compound name

2-[1-(trifluoromethyl)cyclobutyl]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 167.09218 Da
Monoisotopic Mass: 1.9
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]+	168.09946	145.1
[M+Na]+	190.08140	147.8
[M+NH4]+	185.12600	148.7
[M+K]+	206.05534	142.9
[M-H]-	166.08490	139.6
[M+Na-2H]-	188.06685	146.3
[M]+	167.09163	142.6
[M]-	167.09273	142.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.