CID 95241072

2095396-41-9

Structural Information

Molecular Formula
C6H10F3N
SMILES
C1C[C@H](C[C@@H]1C(F)(F)F)N
InChI
InChI=1S/C6H10F3N/c7-6(8,9)4-1-2-5(10)3-4/h4-5H,1-3,10H2/t4-,5-/m1/s1
InChIKey
XDOIOCJYPKXXMK-RFZPGFLSSA-N
Compound name
(1R,3R)-3-(trifluoromethyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.07654 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.08382 127.9
[M+Na]+ 176.06576 135.0
[M-H]- 152.06926 126.9
[M+NH4]+ 171.11036 150.2
[M+K]+ 192.03970 133.3
[M+H-H2O]+ 136.07380 120.7
[M+HCOO]- 198.07474 146.8
[M+CH3COO]- 212.09039 176.3
[M+Na-2H]- 174.05121 130.9
[M]+ 153.07599 118.8
[M]- 153.07709 118.8
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.