CID 16228803

3-(2,2,2-trifluoroethoxy)cyclohexan-1-amine

Structural Information

Molecular Formula
C8H14F3NO
SMILES
C1CC(CC(C1)OCC(F)(F)F)N
InChI
InChI=1S/C8H14F3NO/c9-8(10,11)5-13-7-3-1-2-6(12)4-7/h6-7H,1-5,12H2
InChIKey
LQYFONUESJVHHK-UHFFFAOYSA-N
Compound name
3-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.10275 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.11003 145.5
[M+Na]+ 220.09197 151.7
[M+NH4]+ 215.13657 151.2
[M+K]+ 236.06591 147.1
[M-H]- 196.09547 142.5
[M+Na-2H]- 218.07742 147.5
[M]+ 197.10220 145.0
[M]- 197.10330 145.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.