CID 155943634

2613299-74-2

Structural Information

Molecular Formula
C7H10F3N
SMILES
C1[C@H]2[C@@H]1CC(C2)(C(F)(F)F)N
InChI
InChI=1S/C7H10F3N/c8-7(9,10)6(11)2-4-1-5(4)3-6/h4-5H,1-3,11H2/t4-,5+,6?
InChIKey
FZHWJQZEMFAKNT-XEAPYIEGSA-N
Compound name
(1S,5R)-3-(trifluoromethyl)bicyclo[3.1.0]hexan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.07654 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.08382 125.0
[M+Na]+ 188.06576 135.4
[M-H]- 164.06926 126.4
[M+NH4]+ 183.11036 145.0
[M+K]+ 204.03970 132.3
[M+H-H2O]+ 148.07380 119.0
[M+HCOO]- 210.07474 143.2
[M+CH3COO]- 224.09039 182.3
[M+Na-2H]- 186.05121 131.3
[M]+ 165.07599 121.1
[M]- 165.07709 121.1
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

No patent data available for this compound.