CID 58286858

2305731-07-9

Structural Information

Molecular Formula
C6H12FN
SMILES
C[C@@H]1CCNC[C@@H]1F
InChI
InChI=1S/C6H12FN/c1-5-2-3-8-4-6(5)7/h5-6,8H,2-4H2,1H3/t5-,6+/m1/s1
InChIKey
AJTJCPRPZUUJPS-RITPCOANSA-N
Compound name
(3R,4R)-3-fluoro-4-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

117.095375 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.10265 123.7
[M+Na]+ 140.08459 129.8
[M-H]- 116.08810 122.7
[M+NH4]+ 135.12920 144.2
[M+K]+ 156.05853 128.0
[M+H-H2O]+ 100.09264 117.3
[M+HCOO]- 162.09358 141.0
[M+CH3COO]- 176.10923 167.1
[M+Na-2H]- 138.07004 128.7
[M]+ 117.09483 116.0
[M]- 117.09592 116.0
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

patents stripe