CID 22150432

2,2,2-trifluoro-1-(pyrrolidin-2-yl)ethan-1-ol hydrochloride

Structural Information

Molecular Formula
C6H10F3NO
SMILES
C1CC(NC1)C(C(F)(F)F)O
InChI
InChI=1S/C6H10F3NO/c7-6(8,9)5(11)4-2-1-3-10-4/h4-5,10-11H,1-3H2
InChIKey
FRCMYJLVRLEIBR-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-1-pyrrolidin-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

169.07144 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.078716 132.9
[M+Na]+ 192.060658 138.8
[M-H]- 168.064164 128.0
[M+NH4]+ 187.105263 152.0
[M+K]+ 208.034598 136.6
[M+H-H2O]+ 152.068700 125.2
[M+HCOO]- 214.069641 146.3
[M+CH3COO]- 228.085291 171.3
[M+Na-2H]- 190.046106 135.1
[M]+ 169.07089142 122.8
[M]- 169.07198858 122.8
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

patents stripe