CID 96632103

Rac-(2r,3r)-2-(trifluoromethyl)piperidin-3-ol hydrochloride

Structural Information

Molecular Formula
C6H10F3NO
SMILES
C1C[C@H]([C@@H](NC1)C(F)(F)F)O
InChI
InChI=1S/C6H10F3NO/c7-6(8,9)5-4(11)2-1-3-10-5/h4-5,10-11H,1-3H2/t4-,5-/m1/s1
InChIKey
HRXOCFAASSUVGL-RFZPGFLSSA-N
Compound name
(2R,3R)-2-(trifluoromethyl)piperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.07144 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.078716 133.2
[M+Na]+ 192.060658 139.4
[M-H]- 168.064164 128.2
[M+NH4]+ 187.105263 150.8
[M+K]+ 208.034598 136.7
[M+H-H2O]+ 152.068700 125.5
[M+HCOO]- 214.069641 145.4
[M+CH3COO]- 228.085291 171.8
[M+Na-2H]- 190.046106 137.0
[M]+ 169.07089142 122.0
[M]- 169.07198858 122.0
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.