CID 67085452

1315593-71-5

Structural Information

Molecular Formula
C5H9F2NO
SMILES
C1[C@H](NCC1(F)F)CO
InChI
InChI=1S/C5H9F2NO/c6-5(7)1-4(2-9)8-3-5/h4,8-9H,1-3H2/t4-/m0/s1
InChIKey
STLGRNYDDKFZIR-BYPYZUCNSA-N
Compound name
[(2S)-4,4-difluoropyrrolidin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

155
Patents

137.06522 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.07250 128.6
[M+Na]+ 160.05444 136.0
[M+NH4]+ 155.09904 136.3
[M+K]+ 176.02838 131.5
[M-H]- 136.05794 125.2
[M+Na-2H]- 158.03989 132.0
[M]+ 137.06467 128.3
[M]- 137.06577 128.3
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