CID 105533267

Rac-(1r,2r)-2-methyl-2-(trifluoromethyl)cyclopropan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H8F3N
SMILES
C[C@@]1(C[C@@H]1N)C(F)(F)F
InChI
InChI=1S/C5H8F3N/c1-4(2-3(4)9)5(6,7)8/h3H,2,9H2,1H3/t3-,4-/m0/s1
InChIKey
YXIUDBKOWARQFR-IMJSIDKUSA-N
Compound name
cis-(1S,2S)-2-methyl-2-(trifluoromethyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.06088 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.068156 118.3
[M+Na]+ 162.050098 129.0
[M-H]- 138.053604 119.6
[M+NH4]+ 157.094703 136.9
[M+K]+ 178.024038 127.3
[M+H-H2O]+ 122.058140 112.1
[M+HCOO]- 184.059081 138.3
[M+CH3COO]- 198.074731 178.8
[M+Na-2H]- 160.035546 125.5
[M]+ 139.06033142 115.4
[M]- 139.06142858 115.4
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.