CID 154868080

2503207-64-3

Structural Information

Molecular Formula

C₆H₁₀F₃N

SMILES

CC1(CC(C1)C(F)(F)F)N

InChI

InChI=1S/C6H10F3N/c1-5(10)2-4(3-5)6(7,8)9/h4H,2-3,10H2,1H3

InChIKey

ZPXZGPHHHSDUOL-UHFFFAOYSA-N

Compound name

1-methyl-3-(trifluoromethyl)cyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 153.07654 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]+	154.083816	131.3
[M+Na]+	176.065758	138.4
[M-H]-	152.069264	131.2
[M+NH4]+	171.110363	147.6
[M+K]+	192.039698	139.8
[M+H-H2O]+	136.073800	120.6
[M+HCOO]-	198.074741	149.0
[M+CH3COO]-	212.090391	181.3
[M+Na-2H]-	174.051206	136.2
[M]+	153.07599142	133.0
[M]-	153.07708858	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe