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]+ 170.07872 132.9
[M+Na]+ 192.06066 138.8
[M-H]- 168.06416 128.0
[M+NH4]+ 187.10526 152.0
[M+K]+ 208.03460 136.6
[M+H-H2O]+ 152.06870 125.2
[M+HCOO]- 214.06964 146.3
[M+CH3COO]- 228.08529 171.3
[M+Na-2H]- 190.04611 135.1
[M]+ 169.07089 122.8
[M]- 169.07199 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