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]+ 152.08815 128.7
[M+Na]+ 174.07009 136.2
[M-H]- 150.07359 125.4
[M+NH4]+ 169.11469 150.9
[M+K]+ 190.04403 133.7
[M+H-H2O]+ 134.07813 122.4
[M+HCOO]- 196.07907 145.8
[M+CH3COO]- 210.09472 168.6
[M+Na-2H]- 172.05554 132.5
[M]+ 151.08032 121.8
[M]- 151.08142 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.