CID 58398055

2306254-06-6

Structural Information

Molecular Formula
C6H13FN2
SMILES
CN1CC[C@@H]([C@@H](C1)F)N
InChI
InChI=1S/C6H13FN2/c1-9-3-2-6(8)5(7)4-9/h5-6H,2-4,8H2,1H3/t5-,6+/m1/s1
InChIKey
FIWBAIBSPICWNU-RITPCOANSA-N
Compound name
(3R,4S)-3-fluoro-1-methylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

132.10628 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.11356 127.4
[M+Na]+ 155.09550 134.0
[M-H]- 131.09900 127.6
[M+NH4]+ 150.14010 147.7
[M+K]+ 171.06944 132.7
[M+H-H2O]+ 115.10354 120.5
[M+HCOO]- 177.10448 146.5
[M+CH3COO]- 191.12013 175.0
[M+Na-2H]- 153.08095 131.4
[M]+ 132.10573 120.2
[M]- 132.10683 120.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe