CID 67441734

Cis-3-fluoro-4-methylpyrrolidine hydrochloride

Structural Information

Molecular Formula
C5H10FN
SMILES
C[C@@H]1CNC[C@@H]1F
InChI
InChI=1S/C5H10FN/c1-4-2-7-3-5(4)6/h4-5,7H,2-3H2,1H3/t4-,5+/m1/s1
InChIKey
HPCFSOFBKLAFII-UHNVWZDZSA-N
Compound name
(3R,4R)-3-fluoro-4-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

103.07973 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.08701 120.9
[M+Na]+ 126.06895 130.4
[M+NH4]+ 121.11355 129.3
[M+K]+ 142.04289 126.5
[M-H]- 102.07245 120.2
[M+Na-2H]- 124.05440 124.8
[M]+ 103.07918 121.7
[M]- 103.08028 121.7
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