CID 69425166

2089257-34-9

Structural Information

Molecular Formula

C₆H₁₀F₃N

SMILES

C1CC1CC(C(F)(F)F)N

InChI

InChI=1S/C6H10F3N/c7-6(8,9)5(10)3-4-1-2-4/h4-5H,1-3,10H2

InChIKey

KWYQEGWKRJFSPU-UHFFFAOYSA-N

Compound name

3-cyclopropyl-1,1,1-trifluoropropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 153.07654 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]+	154.083816	122.2
[M+Na]+	176.065758	130.7
[M-H]-	152.069264	122.6
[M+NH4]+	171.110363	137.9
[M+K]+	192.039698	128.3
[M+H-H2O]+	136.073800	114.3
[M+HCOO]-	198.074741	141.4
[M+CH3COO]-	212.090391	181.9
[M+Na-2H]-	174.051206	127.3
[M]+	153.07599142	118.3
[M]-	153.07708858	118.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe