CID 97296880

2137837-57-9

Structural Information

Molecular Formula
C5H8F3N
SMILES
C1[C@H]([C@@H]1C(F)(F)F)CN
InChI
InChI=1S/C5H8F3N/c6-5(7,8)4-1-3(4)2-9/h3-4H,1-2,9H2/t3-,4+/m0/s1
InChIKey
YBEXADVXCHNUQP-IUYQGCFVSA-N
Compound name
[(1R,2R)-2-(trifluoromethyl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.06088 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.06816 132.1
[M+Na]+ 162.05010 139.5
[M+NH4]+ 157.09470 138.3
[M+K]+ 178.02404 137.2
[M-H]- 138.05360 134.9
[M+Na-2H]- 160.03555 136.9
[M]+ 139.06033 134.5
[M]- 139.06143 134.5
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.