CID 146049925

2-(4,4-difluoropyrrolidin-2-yl)ethan-1-ol hydrochloride

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1C(NCC1(F)F)CCO
InChI
InChI=1S/C6H11F2NO/c7-6(8)3-5(1-2-10)9-4-6/h5,9-10H,1-4H2
InChIKey
XZSAHGSCUBMCMB-UHFFFAOYSA-N
Compound name
2-(4,4-difluoropyrrolidin-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.08087 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 128.7
[M+Na]+ 174.070088 136.2
[M-H]- 150.073594 125.4
[M+NH4]+ 169.114693 150.9
[M+K]+ 190.044028 133.7
[M+H-H2O]+ 134.078130 122.4
[M+HCOO]- 196.079071 145.8
[M+CH3COO]- 210.094721 168.6
[M+Na-2H]- 172.055536 132.5
[M]+ 151.08032142 121.8
[M]- 151.08141858 121.8
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.