CID 167716919

(2s,3s)-3-fluoro-2-phenylpiperidine hydrochloride

Structural Information

Molecular Formula
C11H14FN
SMILES
C1C[C@@H]([C@@H](NC1)C2=CC=CC=C2)F
InChI
InChI=1S/C11H14FN/c12-10-7-4-8-13-11(10)9-5-2-1-3-6-9/h1-3,5-6,10-11,13H,4,7-8H2/t10-,11-/m0/s1
InChIKey
OPBCXGXWTKRWQT-QWRGUYRKSA-N
Compound name
(2S,3S)-3-fluoro-2-phenylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.11102 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.11830 138.5
[M+Na]+ 202.10024 143.9
[M-H]- 178.10374 140.3
[M+NH4]+ 197.14484 156.1
[M+K]+ 218.07418 139.8
[M+H-H2O]+ 162.10828 130.3
[M+HCOO]- 224.10922 155.7
[M+CH3COO]- 238.12487 149.8
[M+Na-2H]- 200.08569 143.4
[M]+ 179.11047 130.1
[M]- 179.11157 130.1
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.