CID 28901538

1258640-83-3

Structural Information

Molecular Formula
C4H6F3N
SMILES
C1[C@@H]([C@@H]1N)C(F)(F)F
InChI
InChI=1S/C4H6F3N/c5-4(6,7)2-1-3(2)8/h2-3H,1,8H2/t2-,3+/m0/s1
InChIKey
UDWSAEWNKJDWHU-STHAYSLISA-N
Compound name
(1R,2S)-2-(trifluoromethyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

125.045235 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.05251 128.5
[M+Na]+ 148.03445 136.1
[M+NH4]+ 143.07906 134.9
[M+K]+ 164.00839 134.0
[M-H]- 124.03796 131.4
[M+Na-2H]- 146.01990 133.5
[M]+ 125.04469 130.9
[M]- 125.04578 130.9
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.