CID 89539071

4,4-difluoropyrrolidin-3-ol

Structural Information

Molecular Formula
C4H7F2NO
SMILES
C1C(C(CN1)(F)F)O
InChI
InChI=1S/C4H7F2NO/c5-4(6)2-7-1-3(4)8/h3,7-8H,1-2H2
InChIKey
BYLFAFMPLXFJDF-UHFFFAOYSA-N
Compound name
4,4-difluoropyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

138
Patents

123.04957 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.05685 124.2
[M+Na]+ 146.03879 131.9
[M+NH4]+ 141.08339 132.1
[M+K]+ 162.01273 127.6
[M-H]- 122.04229 120.9
[M+Na-2H]- 144.02424 127.9
[M]+ 123.04902 124.0
[M]- 123.05012 124.0
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