CID 137838556

(2s,4s)-2-(fluoromethyl)-4-methoxypyrrolidine hydrochloride

Structural Information

Molecular Formula
C6H12FNO
SMILES
CO[C@H]1C[C@H](NC1)CF
InChI
InChI=1S/C6H12FNO/c1-9-6-2-5(3-7)8-4-6/h5-6,8H,2-4H2,1H3/t5-,6-/m0/s1
InChIKey
FDSQVTOGYVLLKW-WDSKDSINSA-N
Compound name
(2S,4S)-2-(fluoromethyl)-4-methoxypyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.09029 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.09757 126.7
[M+Na]+ 156.07951 133.7
[M-H]- 132.08301 125.9
[M+NH4]+ 151.12411 148.4
[M+K]+ 172.05345 132.4
[M+H-H2O]+ 116.08755 120.2
[M+HCOO]- 178.08849 146.4
[M+CH3COO]- 192.10414 168.9
[M+Na-2H]- 154.06496 130.3
[M]+ 133.08974 122.5
[M]- 133.09084 122.5
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.