CID 11958242

((2s,4r)-4-fluoropyrrolidin-2-yl)methanol hydrochloride

Structural Information

Molecular Formula
C5H10FNO
SMILES
C1[C@@H](CN[C@@H]1CO)F
InChI
InChI=1S/C5H10FNO/c6-4-1-5(3-8)7-2-4/h4-5,7-8H,1-3H2/t4-,5-/m0/s1
InChIKey
GDLHZOVMBZPGEL-WHFBIAKZSA-N
Compound name
[(2S,4S)-4-fluoropyrrolidin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

101
Patents

119.07464 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.08192 122.9
[M+Na]+ 142.06386 129.9
[M-H]- 118.06736 120.9
[M+NH4]+ 137.10846 144.4
[M+K]+ 158.03780 127.9
[M+H-H2O]+ 102.07190 116.8
[M+HCOO]- 164.07284 141.4
[M+CH3COO]- 178.08849 163.2
[M+Na-2H]- 140.04931 126.5
[M]+ 119.07409 116.5
[M]- 119.07519 116.5
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

patents stripe