CID 154814305

2550997-27-6

Structural Information

Molecular Formula
C5H7F3O2
SMILES
C1[C@@H](CO[C@@H]1C(F)(F)F)O
InChI
InChI=1S/C5H7F3O2/c6-5(7,8)4-1-3(9)2-10-4/h3-4,9H,1-2H2/t3-,4-/m0/s1
InChIKey
GGKOZVUVOBRWJQ-IMJSIDKUSA-N
Compound name
(3S,5S)-5-(trifluoromethyl)oxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.03981 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.04709 125.2
[M+Na]+ 179.02903 133.2
[M-H]- 155.03253 124.2
[M+NH4]+ 174.07363 146.0
[M+K]+ 195.00297 133.1
[M+H-H2O]+ 139.03707 118.9
[M+HCOO]- 201.03801 142.1
[M+CH3COO]- 215.05366 170.5
[M+Na-2H]- 177.01448 130.3
[M]+ 156.03926 119.2
[M]- 156.04036 119.2
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.