CID 165946396

(1s,3r)-3-(trifluoromethoxy)cyclopentan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H10F3NO
SMILES
C1C[C@H](C[C@H]1N)OC(F)(F)F
InChI
InChI=1S/C6H10F3NO/c7-6(8,9)11-5-2-1-4(10)3-5/h4-5H,1-3,10H2/t4-,5+/m0/s1
InChIKey
PNPKBKBHPYUXOM-CRCLSJGQSA-N
Compound name
(1S,3R)-3-(trifluoromethoxy)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.07144 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.07872 130.8
[M+Na]+ 192.06066 137.9
[M-H]- 168.06416 129.8
[M+NH4]+ 187.10526 152.4
[M+K]+ 208.03460 136.6
[M+H-H2O]+ 152.06870 123.5
[M+HCOO]- 214.06964 149.9
[M+CH3COO]- 228.08529 178.3
[M+Na-2H]- 190.04611 133.9
[M]+ 169.07089 123.2
[M]- 169.07199 123.2
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.