CID 132398901

3-fluoro-2-methyloxolane-3-carboxylic acid

Structural Information

Molecular Formula
C6H9FO3
SMILES
CC1C(CCO1)(C(=O)O)F
InChI
InChI=1S/C6H9FO3/c1-4-6(7,5(8)9)2-3-10-4/h4H,2-3H2,1H3,(H,8,9)
InChIKey
GMIQOMJPBUCXJJ-UHFFFAOYSA-N
Compound name
3-fluoro-2-methyloxolane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

148.05357 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.06085 125.8
[M+Na]+ 171.04279 133.8
[M-H]- 147.04629 127.7
[M+NH4]+ 166.08739 148.8
[M+K]+ 187.01673 134.3
[M+H-H2O]+ 131.05083 121.7
[M+HCOO]- 193.05177 145.5
[M+CH3COO]- 207.06742 169.8
[M+Na-2H]- 169.02824 130.9
[M]+ 148.05302 123.7
[M]- 148.05412 123.7
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.