CID 131451950

2,4,4-trifluorocyclohexan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H10F3N
SMILES
C1CC(CC(C1N)F)(F)F
InChI
InChI=1S/C6H10F3N/c7-4-3-6(8,9)2-1-5(4)10/h4-5H,1-3,10H2
InChIKey
JJJMJVVVFVVZMW-UHFFFAOYSA-N
Compound name
2,4,4-trifluorocyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.07654 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.08382 127.2
[M+Na]+ 176.06576 134.8
[M-H]- 152.06926 126.5
[M+NH4]+ 171.11036 149.8
[M+K]+ 192.03970 132.9
[M+H-H2O]+ 136.07380 120.3
[M+HCOO]- 198.07474 145.5
[M+CH3COO]- 212.09039 177.6
[M+Na-2H]- 174.05121 131.1
[M]+ 153.07599 117.3
[M]- 153.07709 117.3
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.