CID 145709235

2165729-43-9

Structural Information

Molecular Formula
C5H6F2O3
SMILES
C1[C@H](OCC1(F)F)C(=O)O
InChI
InChI=1S/C5H6F2O3/c6-5(7)1-3(4(8)9)10-2-5/h3H,1-2H2,(H,8,9)/t3-/m0/s1
InChIKey
RKZXHJRHGLOJQR-VKHMYHEASA-N
Compound name
(2S)-4,4-difluorooxolane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.0285 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.03578 123.7
[M+Na]+ 175.01772 132.1
[M-H]- 151.02122 124.3
[M+NH4]+ 170.06232 146.4
[M+K]+ 190.99166 132.4
[M+H-H2O]+ 135.02576 118.7
[M+HCOO]- 197.02670 142.7
[M+CH3COO]- 211.04235 169.6
[M+Na-2H]- 173.00317 128.7
[M]+ 152.02795 120.0
[M]- 152.02905 120.0
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.