CID 24697797

N-(2,2,2-trifluoroethyl)cyclopentanamine

Structural Information

Molecular Formula
C7H12F3N
SMILES
C1CCC(C1)NCC(F)(F)F
InChI
InChI=1S/C7H12F3N/c8-7(9,10)5-11-6-3-1-2-4-6/h6,11H,1-5H2
InChIKey
YDZJAXDALRSDQG-UHFFFAOYSA-N
Compound name
N-(2,2,2-trifluoroethyl)cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

167.09218 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.09946 139.7
[M+Na]+ 190.08140 145.4
[M+NH4]+ 185.12600 145.9
[M+K]+ 206.05534 142.0
[M-H]- 166.08490 136.6
[M+Na-2H]- 188.06685 142.0
[M]+ 167.09163 139.1
[M]- 167.09273 139.1
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

patents stripe